N-(5-chloro-2,4-dimethoxyphenyl)-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-(5-chloro-2,4-dimethoxyphenyl)-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-(5-chloro-2,4-dimethoxyphenyl)-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: | G281-1353 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-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: | 540.1 |
| Molecular Formula: | C27 H26 Cl N3 O3 S2 |
| Smiles: | COc1cc(c(cc1NC(N1Cc2c3CCCCc3sc2n2cccc2C1c1cccs1)=O)[Cl])OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.1828 |
| logD: | 7.1827 |
| logSw: | -6.4444 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.525 |
| InChI Key: | VHWYZYJZCHWVSC-VWLOTQADSA-N |