methyl 10-[2-(4-methylanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
methyl 10-[2-(4-methylanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
methyl 10-[2-(4-methylanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0223 |
| Compound Name: | methyl 10-[2-(4-methylanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 432.5 |
| Molecular Formula: | C24 H20 N2 O4 S |
| Smiles: | Cc1ccc(cc1)NC(CN1C(c2ccccc2Sc2ccc(cc12)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1471 |
| logD: | 5.1471 |
| logSw: | -4.8561 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.724 |
| InChI Key: | MIBYPOKVUXIWQM-UHFFFAOYSA-N |