N-[4-(diethylamino)-2-methylphenyl]-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-[4-(diethylamino)-2-methylphenyl]-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide
N-[4-(diethylamino)-2-methylphenyl]-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E975-1203 |
| Compound Name: | N-[4-(diethylamino)-2-methylphenyl]-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C22 H27 N3 O5 S |
| Smiles: | CCN(CC)c1ccc(c(C)c1)NC(CCS(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3077 |
| logD: | 2.0984 |
| logSw: | -3.0283 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.057 |
| InChI Key: | DOUITZDSDLQITM-UHFFFAOYSA-N |