N4-Acetyl-N1-(4,5-Dimethyloxazol-2-Yl)-Sulfanilamide - CAS 36326-07-5
Catalog: |
BB054864 |
Product Name: |
N4-Acetyl-N1-(4,5-Dimethyloxazol-2-Yl)-Sulfanilamide |
CAS: |
36326-07-5 |
Synonyms: |
N-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfamoyl]phenyl]acetamide; N4-Acetyl-N1-(4,5-Dimethyloxazol-2-Yl)-Sulfanilamide; Acetamide,N-[4-[[(4,5-dimethyl-2-oxazolyl)amino]sulfonyl]phenyl]-; N-(4-(N-(4,5-Dimethyloxazol-2-yl)sulfamoyl)phenyl)acetamide; N-(4-{[(4,5-dimethyl-1,3-oxazol-2-yl)amino]sulfonyl}phenyl)acetamide |
IUPAC Name: | N-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfamoyl]phenyl]acetamide |
Molecular Weight: | 309.34 |
Molecular Formula: | C13H15N3O4S |
Canonical SMILES: | CC1=C(OC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C)C |
InChI: | InChI=1S/C13H15N3O4S/c1-8-9(2)20-13(14-8)16-21(18,19)12-6-4-11(5-7-12)15-10(3)17/h4-7H,1-3H3,(H,14,16)(H,15,17) |
InChI Key: | BCGBRLMXWWNZLS-UHFFFAOYSA-N |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264+P265, P280, P305+P351+P338, and P337+P317 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
DE-1128429-B | Process for the preparation of 4,5-substituted 2-aminooxazoles | 19600519 |
DE-1121052-B | Process for the preparation of 4, 5-substituted 2-amino-oxazoles | 19600201 |
Complexity: | 468 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 309.07832714 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 309.07832714 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 110Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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