N-cyclopropyl-4-({[4-ethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-cyclopropyl-4-({[4-ethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)benzamide
N-cyclopropyl-4-({[4-ethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)benzamide
Compound characteristics
Compound ID: | V014-3161 |
Compound Name: | N-cyclopropyl-4-({[4-ethyl-6-(4-ethylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)benzamide |
Molecular Weight: | 425.6 |
Molecular Formula: | C23 H31 N5 O S |
Salt: | not_available |
Smiles: | CCc1cc(nc(n1)SCc1ccc(cc1)C(NC1CC1)=O)N1CCN(CC)CC1 |
Stereo: | ACHIRAL |
logP: | 3.7409 |
logD: | 3.0535 |
logSw: | -3.8486 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.678 |
InChI Key: | PVRCBYOKFDFUFA-UHFFFAOYSA-N |