3-(5-chloro-2-methylphenyl)-8-methoxy-5-methyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Chemical Structure Depiction of
3-(5-chloro-2-methylphenyl)-8-methoxy-5-methyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
3-(5-chloro-2-methylphenyl)-8-methoxy-5-methyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Compound characteristics
| Compound ID: | E737-0804 |
| Compound Name: | 3-(5-chloro-2-methylphenyl)-8-methoxy-5-methyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione |
| Molecular Weight: | 480.95 |
| Molecular Formula: | C25 H25 Cl N4 O4 |
| Smiles: | Cc1ccc(cc1N1C(c2c(c3cc(ccc3n2C)OC)N(CC(N2CCCC2)=O)C1=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.756 |
| logD: | 3.756 |
| logSw: | -4.1783 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.737 |
| InChI Key: | ACNULJOADQVFLN-UHFFFAOYSA-N |