N-(2,4-dimethylphenyl)-4-(thiophen-2-yl)-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-(thiophen-2-yl)-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-(thiophen-2-yl)-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: | G281-1369 |
| Compound Name: | N-(2,4-dimethylphenyl)-4-(thiophen-2-yl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 473.66 |
| Molecular Formula: | C27 H27 N3 O S2 |
| Smiles: | Cc1ccc(c(C)c1)NC(N1Cc2c3CCCCc3sc2n2cccc2C1c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.3666 |
| logD: | 7.3666 |
| logSw: | -5.4572 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.2638 |
| InChI Key: | CXWVSJXNFBAHLF-RUZDIDTESA-N |