3-(5-chloro-2-methylphenyl)-8-methoxy-1-[(4-methoxyphenyl)methyl]-5-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Chemical Structure Depiction of
3-(5-chloro-2-methylphenyl)-8-methoxy-1-[(4-methoxyphenyl)methyl]-5-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
3-(5-chloro-2-methylphenyl)-8-methoxy-1-[(4-methoxyphenyl)methyl]-5-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Compound characteristics
| Compound ID: | E737-0825 |
| Compound Name: | 3-(5-chloro-2-methylphenyl)-8-methoxy-1-[(4-methoxyphenyl)methyl]-5-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione |
| Molecular Weight: | 489.96 |
| Molecular Formula: | C27 H24 Cl N3 O4 |
| Smiles: | Cc1ccc(cc1N1C(c2c(c3cc(ccc3n2C)OC)N(Cc2ccc(cc2)OC)C1=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.623 |
| logD: | 5.623 |
| logSw: | -5.8539 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.522 |
| InChI Key: | UGFWTICWNFGYNV-UHFFFAOYSA-N |