N-[4-(diethylamino)-2-methylphenyl]-3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamide
Chemical Structure Depiction of
N-[4-(diethylamino)-2-methylphenyl]-3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamide
N-[4-(diethylamino)-2-methylphenyl]-3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamide
Compound characteristics
| Compound ID: | L995-0187 |
| Compound Name: | N-[4-(diethylamino)-2-methylphenyl]-3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamide |
| Molecular Weight: | 456.56 |
| Molecular Formula: | C23 H28 N4 O4 S |
| Smiles: | CCN(CC)c1ccc(c(C)c1)NS(c1ccc2c(c1)c(C(N1CCCC1)=O)no2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8562 |
| logD: | 3.1164 |
| logSw: | -3.8269 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.14 |
| InChI Key: | XYISNSYFLJOODY-UHFFFAOYSA-N |