N-(5-chloro-2-methoxyphenyl)-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
N-(5-chloro-2-methoxyphenyl)-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Compound characteristics
| Compound ID: | C714-0434 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide |
| Molecular Weight: | 543.04 |
| Molecular Formula: | C27 H27 Cl N2 O6 S |
| Smiles: | COc1ccc(cc1NC(CN1C(CC(c2cc(c(c(c2)OC)OC)OC)Sc2ccccc12)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.77 |
| logD: | 4.763 |
| logSw: | -4.8284 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.738 |
| InChI Key: | DELVVDKBGSKSDM-XMMPIXPASA-N |