6C3L8Dwf8A
Also known as Benzeneacetamide, N-methyl-N-[4-methyl-5-[(methylamino)sulfonyl]-2-thiazolyl]-4-(2-pyridinyl)-, N-[5-(Methylaminosulfonyl)-4-methyl-1,3-thiazol-2-yl]-N-methyl-2-[4-(2-pyridinyl)phenyl]acetamide, N-Methyl-N-[4-methyl-5-[(methylamino)sulfonyl]-2-thiazolyl]-4-(2-pyridinyl)benzeneacetamide
Key facts
What buyers check first
- CAS number
- 348087-10-5
- Formula
- C19H20N4O3S2
- Molar mass
- 416.53 g/mol
- HS code
- 293590
- Category
- Screening compounds
What is 6C3L8Dwf8A?
Plain description, key identifiers and synonyms
6C3L8Dwf8A is a chemical substance with the molecular formula C19H20N4O3S2 and a molar mass of 416.53 g/mol. Its CAS registry number is 348087-10-5. The IUPAC name is N-methyl-N-[4-methyl-5-(methylsulfamoyl)-1,3-thiazol-2-yl]-2-(4-pyridin-2-ylphenyl)acetamide.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- N-methyl-N-[4-methyl-5-(methylsulfamoyl)-1,3-thiazol-2-yl]-2-(4-pyridin-2-ylphenyl)acetamide
- CAS number
- 348087-10-5
- Molecular formula
- C19H20N4O3S2
- UNII
- 6C3L8DWF8A
- InChIKey
- PKGVFKBMLOJVIY-UHFFFAOYSA-N
- InChI
- InChI=1S/C19H20N4O3S2/c1-13-18(28(25,26)20-2)27-19(22-13)23(3)17(24)12-14-7-9-15(10-8-14)16-6-4-5-11-21-16/h4-11,20H,12H2,1-3H3
- SMILES (canonical and isomeric)
- CC1=C(SC(=N1)N(C)C(=O)CC2=CC=C(C=C2)C3=CC=CC=N3)S(=O)(=O)NC
Synonyms
- Benzeneacetamide, N-methyl-N-[4-methyl-5-[(methylamino)sulfonyl]-2-thiazolyl]-4-(2-pyridinyl)-
- N-[5-(Methylaminosulfonyl)-4-methyl-1,3-thiazol-2-yl]-N-methyl-2-[4-(2-pyridinyl)phenyl]acetamide
- N-Methyl-N-[4-methyl-5-[(methylamino)sulfonyl]-2-thiazolyl]-4-(2-pyridinyl)benzeneacetamide
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 416.53 g/molcalc.Computed value |
|---|---|
| Exact mass | 416.0977 Dacalc.Computed value |
| LogP (octanol/water) | 2.63calc.Computed value |
| Topological polar surface area | 92.26 Ųcalc.Computed value |
| Hydrogen bond donors | 1calc.Computed value |
| Hydrogen bond acceptors | 6calc.Computed value |
| Rotatable bonds | 6calc.Computed value |
| Heavy atoms | 28calc.Computed value |
| Rings | 3calc.Computed value |
| Aromatic rings | 3calc.Computed value |
| Fraction sp3 carbons | 0.21calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
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6C3L8Dwf8A price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Industries and functions
Regulatory status
Inventories, regulations and trade controls that list this substance
No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code 6C3L8Dwf8A is traded under.
Sulphonamides, other
- United States23.6%
- Slovenia19.1%
- Spain11.7%
* Partner reported figures, a lower bound.
The HS code shown for 6C3L8Dwf8A is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Related chemicals
Parent and salt forms, stereoisomers, similar structures and isomers
Similar structures
Nearest neighbours by Morgan fingerprint Tanimoto similarity
Same formula isomers
Different compounds that share this molecular formula
![4-Benzyl-5-[3-(morpholine-4-sulfonyl)phenyl]-4H-1,2,4-triazole-3-thiol chemical structure, C19H20N4O3S2, CAS 750601-75-3](/s/WKIXIDMEULPYHT-UHFFFAOYSA-N.svg)
![N-(5-Methyl-1,2-oxazol-3-yl)-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide chemical structure, C19H20N4O3S2, CAS 670270-17-4](/s/DJHPJYNZJFHTAB-UHFFFAOYSA-N.svg)
![Ethyl 2-[[4-benzyl-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate chemical structure, C19H20N4O3S2, CAS 689748-61-6](/s/GARJSKTXSMQKFR-UHFFFAOYSA-N.svg)
![2-{[4-Allyl-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide chemical structure, C19H20N4O3S2, CAS 586989-80-2](/s/JBYNKRXSPMSSID-UHFFFAOYSA-N.svg)
![2-{[4-Allyl-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dimethoxyphenyl)acetamide chemical structure, C19H20N4O3S2, CAS 579439-80-8](/s/NJKJLILUWDXPSL-UHFFFAOYSA-N.svg)
![N-(3,4-Dimethoxyphenyl)-2-[6-(2,4-dimethyl-1,3-thiazol-5-yl)pyridazin-3-yl]sulfanylacetamide chemical structure, C19H20N4O3S2, CAS 872988-17-5](/s/XIDXYMIHSMFTCT-UHFFFAOYSA-N.svg)
![(Z)-5-((2-Morpholino-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-3-propyl-2-thioxothiazolidin-4-one chemical structure, C19H20N4O3S2, CAS 378757-01-8](/s/ICNXEQCGAOUKGK-OWBHPGMISA-N.svg)
![2-[(3-Cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)acetamide chemical structure, C19H20N4O3S2, CAS 337505-13-2](/s/OCRASINPRVHTDY-UHFFFAOYSA-N.svg)
Frequently asked questions
Quick answers about 6C3L8Dwf8A, based on the data on this page
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