N-(3-chloro-4-methylphenyl)-4-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-4-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
N-(3-chloro-4-methylphenyl)-4-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V012-2355 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-4-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide |
| Molecular Weight: | 470.04 |
| Molecular Formula: | C24 H28 Cl N5 O S |
| Salt: | not_available |
| Smiles: | CCc1nc(c2c3CCCCc3sc2n1)N1CCN(CC1)C(Nc1ccc(C)c(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.721 |
| logD: | 6.2914 |
| logSw: | -6.4119 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.488 |
| InChI Key: | SYMKRJLHLSOFNC-UHFFFAOYSA-N |