N-{2-[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]-1,3-benzothiazol-6-yl}cyclohexanecarboxamide
Chemical Structure Depiction of
N-{2-[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]-1,3-benzothiazol-6-yl}cyclohexanecarboxamide
N-{2-[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]-1,3-benzothiazol-6-yl}cyclohexanecarboxamide
Compound characteristics
Compound ID: | 8009-1291 |
Compound Name: | N-{2-[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]-1,3-benzothiazol-6-yl}cyclohexanecarboxamide |
Molecular Weight: | 433.59 |
Molecular Formula: | C21 H27 N3 O3 S2 |
Smiles: | C1CCC(CC1)C(Nc1ccc2c(c1)sc(n2)SCC(NCC1CCCO1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3798 |
logD: | 3.3798 |
logSw: | -3.6256 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 65.457 |
InChI Key: | KLAGUGTZTLNHHD-MRXNPFEDSA-N |