N-(2,4-dimethylphenyl)-4-(4-ethoxyphenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-4-(4-ethoxyphenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
N-(2,4-dimethylphenyl)-4-(4-ethoxyphenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G281-0207 |
| Compound Name: | N-(2,4-dimethylphenyl)-4-(4-ethoxyphenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 511.69 |
| Molecular Formula: | C31 H33 N3 O2 S |
| Smiles: | CCOc1ccc(cc1)C1c2cccn2c2c(CN1C(Nc1ccc(C)cc1C)=O)c1CCCCc1s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.1113 |
| logD: | 8.1113 |
| logSw: | -5.5085 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.369 |
| InChI Key: | HWHGKBYOMDTXFU-LJAQVGFWSA-N |