3-({[4-(4-acetylpiperazin-1-yl)-6-tert-butylpyrimidin-2-yl]sulfanyl}methyl)-N-(cyclopropylmethyl)benzamide
Chemical Structure Depiction of
3-({[4-(4-acetylpiperazin-1-yl)-6-tert-butylpyrimidin-2-yl]sulfanyl}methyl)-N-(cyclopropylmethyl)benzamide
3-({[4-(4-acetylpiperazin-1-yl)-6-tert-butylpyrimidin-2-yl]sulfanyl}methyl)-N-(cyclopropylmethyl)benzamide
Compound characteristics
| Compound ID: | V003-4641 |
| Compound Name: | 3-({[4-(4-acetylpiperazin-1-yl)-6-tert-butylpyrimidin-2-yl]sulfanyl}methyl)-N-(cyclopropylmethyl)benzamide |
| Molecular Weight: | 481.66 |
| Molecular Formula: | C26 H35 N5 O2 S |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)c1cc(C(C)(C)C)nc(n1)SCc1cccc(c1)C(NCC1CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7191 |
| logD: | 4.7185 |
| logSw: | -4.518 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.308 |
| InChI Key: | YBOOKSAGHAXZJD-UHFFFAOYSA-N |