5-(4-chlorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-(4-chlorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]thieno[2,3-d]pyrimidin-4(3H)-one
5-(4-chlorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V031-1435 |
| Compound Name: | 5-(4-chlorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 374.89 |
| Molecular Formula: | C18 H19 Cl N4 O S |
| Salt: | not_available |
| Smiles: | CN1CCN(CC1)CC1NC(c2c(csc2N=1)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5989 |
| logD: | 2.1294 |
| logSw: | -3.8755 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.012 |
| InChI Key: | KTHLBFLDGRHJNF-UHFFFAOYSA-N |