4-[(4-chlorophenyl)methyl]-N-[3-(propylsulfanyl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(4-chlorophenyl)methyl]-N-[3-(propylsulfanyl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(4-chlorophenyl)methyl]-N-[3-(propylsulfanyl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C700-0407 |
| Compound Name: | 4-[(4-chlorophenyl)methyl]-N-[3-(propylsulfanyl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 435.05 |
| Molecular Formula: | C22 H27 Cl N2 O S2 |
| Smiles: | CCCSCCCNC(c1ccc2c(c1)N(CCS2)Cc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.896 |
| logD: | 4.896 |
| logSw: | -4.9587 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.3276 |
| InChI Key: | NJGLXIKQXCPVFQ-UHFFFAOYSA-N |