N-(3-methylbutyl)-4-(4-methylphenyl)-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-(3-methylbutyl)-4-(4-methylphenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
N-(3-methylbutyl)-4-(4-methylphenyl)-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: | G281-0664 |
| Compound Name: | N-(3-methylbutyl)-4-(4-methylphenyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 447.64 |
| Molecular Formula: | C27 H33 N3 O S |
| Smiles: | CC(C)CCNC(N1Cc2c3CCCCc3sc2n2cccc2C1c1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.5591 |
| logD: | 7.5591 |
| logSw: | -5.5677 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.3784 |
| InChI Key: | KOMTWMKUTKQWOP-VWLOTQADSA-N |