N-(3-chlorophenyl)-2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]acetamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]acetamide
N-(3-chlorophenyl)-2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]acetamide
Compound characteristics
| Compound ID: | E737-0204 |
| Compound Name: | N-(3-chlorophenyl)-2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]acetamide |
| Molecular Weight: | 486.96 |
| Molecular Formula: | C27 H23 Cl N4 O3 |
| Smiles: | Cc1cccc(c1)N1C(c2c(c3cc(C)ccc3n2C)N(CC(Nc2cccc(c2)[Cl])=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4503 |
| logD: | 5.4502 |
| logSw: | -5.7241 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.885 |
| InChI Key: | FPUFRMXZPLKIHD-UHFFFAOYSA-N |