2-(4-chlorophenoxy)-1-{4-[2-(propan-2-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenoxy)-1-{4-[2-(propan-2-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
2-(4-chlorophenoxy)-1-{4-[2-(propan-2-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V012-5090 |
| Compound Name: | 2-(4-chlorophenoxy)-1-{4-[2-(propan-2-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 499.07 |
| Molecular Formula: | C26 H31 Cl N4 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)c1nc(c2c3CCCCCc3sc2n1)N1CCN(CC1)C(COc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.294 |
| logD: | 5.7978 |
| logSw: | -6.1768 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.979 |
| InChI Key: | VIXKXZXHGWCZNC-UHFFFAOYSA-N |