N-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)-9-methyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)-9-methyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
N-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)-9-methyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G281-2553 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)-9-methyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 544.67 |
| Molecular Formula: | C30 H32 N4 O4 S |
| Smiles: | CN1CCc2c3CN(C(c4cccc(c4)OC)c4cccn4c3sc2C1)C(Nc1ccc(c(c1)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0687 |
| logD: | 3.3048 |
| logSw: | -4.6827 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.158 |
| InChI Key: | KCIYKDJIMJBNGO-NDEPHWFRSA-N |