3-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-6-methyl-5-(morpholine-4-sulfonyl)thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-6-methyl-5-(morpholine-4-sulfonyl)thieno[2,3-d]pyrimidin-4(3H)-one
3-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-6-methyl-5-(morpholine-4-sulfonyl)thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C096-0329 |
| Compound Name: | 3-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-6-methyl-5-(morpholine-4-sulfonyl)thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 552.07 |
| Molecular Formula: | C23 H26 Cl N5 O5 S2 |
| Smiles: | Cc1c(c2C(N(CC(N3CCN(CC3)c3cccc(c3)[Cl])=O)C=Nc2s1)=O)S(N1CCOCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3774 |
| logD: | 1.3774 |
| logSw: | -3.0658 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.513 |
| InChI Key: | OCIPAUVKVIMTAO-UHFFFAOYSA-N |