4-(5-chloro-2-methoxyphenyl)-10-methyl-3-oxo-N-{3-[(propan-2-yl)oxy]propyl}-3,4,5,10-tetrahydro-2H-[1,4]thiazepino[7,6-b]indole-5-carboxamide
Chemical Structure Depiction of
4-(5-chloro-2-methoxyphenyl)-10-methyl-3-oxo-N-{3-[(propan-2-yl)oxy]propyl}-3,4,5,10-tetrahydro-2H-[1,4]thiazepino[7,6-b]indole-5-carboxamide
4-(5-chloro-2-methoxyphenyl)-10-methyl-3-oxo-N-{3-[(propan-2-yl)oxy]propyl}-3,4,5,10-tetrahydro-2H-[1,4]thiazepino[7,6-b]indole-5-carboxamide
Compound characteristics
| Compound ID: | G202-0417 |
| Compound Name: | 4-(5-chloro-2-methoxyphenyl)-10-methyl-3-oxo-N-{3-[(propan-2-yl)oxy]propyl}-3,4,5,10-tetrahydro-2H-[1,4]thiazepino[7,6-b]indole-5-carboxamide |
| Molecular Weight: | 516.06 |
| Molecular Formula: | C26 H30 Cl N3 O4 S |
| Smiles: | CC(C)OCCCNC(C1c2c3ccccc3n(C)c2SCC(N1c1cc(ccc1OC)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8712 |
| logD: | 3.8712 |
| logSw: | -4.372 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.633 |
| InChI Key: | BGJJQPUWXDYJJN-XMMPIXPASA-N |