4-(2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)-N-(3-fluorophenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)-N-(3-fluorophenyl)piperazine-1-carboxamide
4-(2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)-N-(3-fluorophenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V006-4519 |
| Compound Name: | 4-(2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)-N-(3-fluorophenyl)piperazine-1-carboxamide |
| Molecular Weight: | 530.67 |
| Molecular Formula: | C29 H31 F N6 O S |
| Salt: | not_available |
| Smiles: | CCN1CCc2c3c(nc(Cc4ccccc4)nc3sc2C1)N1CCN(CC1)C(Nc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8062 |
| logD: | 5.7288 |
| logSw: | -5.8103 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.687 |
| InChI Key: | FMGSSWDQCRKKRU-UHFFFAOYSA-N |