N-(3-methoxyphenyl)-2-{[3-(3-methoxyphenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-methoxyphenyl)-2-{[3-(3-methoxyphenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide
N-(3-methoxyphenyl)-2-{[3-(3-methoxyphenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | G856-1006 |
Compound Name: | N-(3-methoxyphenyl)-2-{[3-(3-methoxyphenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide |
Molecular Weight: | 486.55 |
Molecular Formula: | C26 H22 N4 O4 S |
Smiles: | COc1cccc(c1)NC(CSC1=Nc2c3ccccc3[nH]c2C(N1c1cccc(c1)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.2782 |
logD: | 4.2782 |
logSw: | -4.4128 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.355 |
InChI Key: | LBRZREKDXIIRPW-UHFFFAOYSA-N |