N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-6-sulfanylidene-5,6-dihydrobenzimidazo[1,2-c]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-6-sulfanylidene-5,6-dihydrobenzimidazo[1,2-c]quinazoline-3-carboxamide
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-6-sulfanylidene-5,6-dihydrobenzimidazo[1,2-c]quinazoline-3-carboxamide
Compound characteristics
Compound ID: | K250-0328 |
Compound Name: | N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-6-sulfanylidene-5,6-dihydrobenzimidazo[1,2-c]quinazoline-3-carboxamide |
Molecular Weight: | 526.66 |
Molecular Formula: | C29 H30 N6 O2 S |
Smiles: | COc1ccc(cc1)N1CCN(CCCNC(c2ccc3c(c2)NC(n2c4ccccc4nc23)=S)=O)CC1 |
Stereo: | ACHIRAL |
logP: | 4.0156 |
logD: | 3.4717 |
logSw: | -4.1507 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 61.444 |
InChI Key: | VLSJBUJHPHZRAW-UHFFFAOYSA-N |