4-(1,3-benzothiazol-2-yl)-1-{4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidin-1-yl}butan-1-one
Chemical Structure Depiction of
4-(1,3-benzothiazol-2-yl)-1-{4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidin-1-yl}butan-1-one
4-(1,3-benzothiazol-2-yl)-1-{4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidin-1-yl}butan-1-one
Compound characteristics
Compound ID: | P435-1849 |
Compound Name: | 4-(1,3-benzothiazol-2-yl)-1-{4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidin-1-yl}butan-1-one |
Molecular Weight: | 466.6 |
Molecular Formula: | C25 H30 N4 O3 S |
Smiles: | Cc1c(C(N2CCCC2)=O)nc(C2CCN(CC2)C(CCCc2nc3ccccc3s2)=O)o1 |
Stereo: | ACHIRAL |
logP: | 3.7327 |
logD: | 3.7327 |
logSw: | -3.8314 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 61.216 |
InChI Key: | SSLHMSGMOMSKQT-UHFFFAOYSA-N |