N-[4-(diethylamino)-2-methylphenyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-[4-(diethylamino)-2-methylphenyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
N-[4-(diethylamino)-2-methylphenyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E511-1178 |
| Compound Name: | N-[4-(diethylamino)-2-methylphenyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide |
| Molecular Weight: | 461.6 |
| Molecular Formula: | C22 H27 N3 O4 S2 |
| Smiles: | CCN(CC)c1ccc(c(C)c1)NC(CCS(c1ccc2c(c1)NC(CS2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2867 |
| logD: | 2.0774 |
| logSw: | -2.8571 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.012 |
| InChI Key: | ATCKVVSZXNGEEV-UHFFFAOYSA-N |