5-(4-chlorophenyl)-2-[(pyrrolidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-(4-chlorophenyl)-2-[(pyrrolidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4(3H)-one
5-(4-chlorophenyl)-2-[(pyrrolidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V031-1603 |
| Compound Name: | 5-(4-chlorophenyl)-2-[(pyrrolidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 345.85 |
| Molecular Formula: | C17 H16 Cl N3 O S |
| Smiles: | C1CCN(C1)CC1NC(c2c(csc2N=1)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4123 |
| logD: | 3.373 |
| logSw: | -4.564 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.901 |
| InChI Key: | BEEQZRBMIBMBLV-UHFFFAOYSA-N |