N-(3,4-dimethylphenyl)-N~3~-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-beta-alaninamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-N~3~-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-beta-alaninamide
N-(3,4-dimethylphenyl)-N~3~-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-beta-alaninamide
Compound characteristics
Compound ID: | G305-2118 |
Compound Name: | N-(3,4-dimethylphenyl)-N~3~-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-beta-alaninamide |
Molecular Weight: | 389.43 |
Molecular Formula: | C18 H19 N3 O5 S |
Smiles: | Cc1ccc(cc1C)NC(CCNS(c1ccc2c(c1)OC(N2)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.7449 |
logD: | 2.7112 |
logSw: | -3.3497 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 98.405 |
InChI Key: | YFDNKXAKRAVXCS-UHFFFAOYSA-N |