2-(3,4-dimethoxyphenyl)-5-[2-(morpholin-4-yl)-2-oxoethyl]-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-5-[2-(morpholin-4-yl)-2-oxoethyl]-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
2-(3,4-dimethoxyphenyl)-5-[2-(morpholin-4-yl)-2-oxoethyl]-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
Compound characteristics
| Compound ID: | C714-0330 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-5-[2-(morpholin-4-yl)-2-oxoethyl]-2,3-dihydro-1,5-benzothiazepin-4(5H)-one |
| Molecular Weight: | 442.53 |
| Molecular Formula: | C23 H26 N2 O5 S |
| Smiles: | COc1ccc(cc1OC)C1CC(N(CC(N2CCOCC2)=O)c2ccccc2S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2196 |
| logD: | 2.2196 |
| logSw: | -2.8062 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.24 |
| InChI Key: | IMHZKBYTFQSQRU-NRFANRHFSA-N |