N-cyclohexyl-2-(8-methoxy-4-oxo-2-sulfanylidene-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
Chemical Structure Depiction of
N-cyclohexyl-2-(8-methoxy-4-oxo-2-sulfanylidene-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
N-cyclohexyl-2-(8-methoxy-4-oxo-2-sulfanylidene-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
Compound characteristics
Compound ID: | C676-0024 |
Compound Name: | N-cyclohexyl-2-(8-methoxy-4-oxo-2-sulfanylidene-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide |
Molecular Weight: | 386.47 |
Molecular Formula: | C19 H22 N4 O3 S |
Smiles: | COc1ccc2c(c1)c1c(C(N(CC(NC3CCCCC3)=O)C(N1)=S)=O)[nH]2 |
Stereo: | ACHIRAL |
logP: | 2.4197 |
logD: | 2.4197 |
logSw: | -2.9199 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 67.017 |
InChI Key: | ABZXYNMLALFERL-UHFFFAOYSA-N |