1-methyl-N-{3-[2-(methylsulfanyl)ethyl]-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-7-yl}-1H-indole-6-carboxamide
Chemical Structure Depiction of
1-methyl-N-{3-[2-(methylsulfanyl)ethyl]-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-7-yl}-1H-indole-6-carboxamide
1-methyl-N-{3-[2-(methylsulfanyl)ethyl]-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-7-yl}-1H-indole-6-carboxamide
Compound characteristics
| Compound ID: | Y043-4404 |
| Compound Name: | 1-methyl-N-{3-[2-(methylsulfanyl)ethyl]-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-7-yl}-1H-indole-6-carboxamide |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C22 H22 N4 O3 S |
| Smiles: | Cn1ccc2ccc(cc12)C(Nc1ccc2c(c1)C(NC(CCSC)C(N2)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4593 |
| logD: | 3.4458 |
| logSw: | -3.7411 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.98 |
| InChI Key: | NLNBXHMCUFBREK-SFHVURJKSA-N |