4-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-10-methyl-3-oxo-3,4,5,10-tetrahydro-2H-[1,4]thiazepino[7,6-b]indole-5-carboxamide
Chemical Structure Depiction of
4-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-10-methyl-3-oxo-3,4,5,10-tetrahydro-2H-[1,4]thiazepino[7,6-b]indole-5-carboxamide
4-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-10-methyl-3-oxo-3,4,5,10-tetrahydro-2H-[1,4]thiazepino[7,6-b]indole-5-carboxamide
Compound characteristics
| Compound ID: | G202-0323 |
| Compound Name: | 4-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-10-methyl-3-oxo-3,4,5,10-tetrahydro-2H-[1,4]thiazepino[7,6-b]indole-5-carboxamide |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C27 H24 F N3 O3 S |
| Smiles: | Cn1c2c(C(C(NCc3ccccc3OC)=O)N(C(CS2)=O)c2ccc(cc2)F)c2ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2444 |
| logD: | 4.2444 |
| logSw: | -4.3699 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.62 |
| InChI Key: | SMHDDVQOPSLMJC-VWLOTQADSA-N |