1-[(3-chlorophenyl)methyl]-8-methoxy-5-methyl-3-(2-phenylethyl)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Chemical Structure Depiction of
1-[(3-chlorophenyl)methyl]-8-methoxy-5-methyl-3-(2-phenylethyl)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
1-[(3-chlorophenyl)methyl]-8-methoxy-5-methyl-3-(2-phenylethyl)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Compound characteristics
Compound ID: | E737-1217 |
Compound Name: | 1-[(3-chlorophenyl)methyl]-8-methoxy-5-methyl-3-(2-phenylethyl)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione |
Molecular Weight: | 473.96 |
Molecular Formula: | C27 H24 Cl N3 O3 |
Smiles: | Cn1c2C(N(CCc3ccccc3)C(N(Cc3cccc(c3)[Cl])c2c2cc(ccc12)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.8938 |
logD: | 5.8938 |
logSw: | -5.8837 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 41.869 |
InChI Key: | GGEZVUAVDGLIPR-UHFFFAOYSA-N |