3-({[4-(4-acetylpiperazin-1-yl)-5,6-dimethylpyrimidin-2-yl]sulfanyl}methyl)-N-(cyclopropylmethyl)benzamide
Chemical Structure Depiction of
3-({[4-(4-acetylpiperazin-1-yl)-5,6-dimethylpyrimidin-2-yl]sulfanyl}methyl)-N-(cyclopropylmethyl)benzamide
3-({[4-(4-acetylpiperazin-1-yl)-5,6-dimethylpyrimidin-2-yl]sulfanyl}methyl)-N-(cyclopropylmethyl)benzamide
Compound characteristics
| Compound ID: | V027-6427 |
| Compound Name: | 3-({[4-(4-acetylpiperazin-1-yl)-5,6-dimethylpyrimidin-2-yl]sulfanyl}methyl)-N-(cyclopropylmethyl)benzamide |
| Molecular Weight: | 453.61 |
| Molecular Formula: | C24 H31 N5 O2 S |
| Smiles: | CC(N1CCN(CC1)c1c(C)c(C)nc(n1)SCc1cccc(c1)C(NCC1CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5465 |
| logD: | 3.5448 |
| logSw: | -3.8197 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.354 |
| InChI Key: | GYSJELHFLXATOO-UHFFFAOYSA-N |