6-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-2-[4-(diphenylmethyl)piperazin-1-yl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-2-[4-(diphenylmethyl)piperazin-1-yl]pyrimidin-4(3H)-one
6-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-2-[4-(diphenylmethyl)piperazin-1-yl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y020-7553 |
| Compound Name: | 6-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-2-[4-(diphenylmethyl)piperazin-1-yl]pyrimidin-4(3H)-one |
| Molecular Weight: | 525.69 |
| Molecular Formula: | C29 H27 N5 O S2 |
| Smiles: | C1CN(CCN1C(c1ccccc1)c1ccccc1)C1NC(C=C(CSc2nc3ccccc3s2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0236 |
| logD: | 5.9306 |
| logSw: | -5.8871 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.734 |
| InChI Key: | IKCJXQSTJQCNNR-UHFFFAOYSA-N |