N-[3-(butylsulfanyl)propyl]-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-[3-(butylsulfanyl)propyl]-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-[3-(butylsulfanyl)propyl]-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C700-0408 |
| Compound Name: | N-[3-(butylsulfanyl)propyl]-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 449.08 |
| Molecular Formula: | C23 H29 Cl N2 O S2 |
| Smiles: | CCCCSCCCNC(c1ccc2c(c1)N(CCS2)Cc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4537 |
| logD: | 5.4537 |
| logSw: | -5.9259 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.3276 |
| InChI Key: | WWHALNRIAVVVCG-UHFFFAOYSA-N |