2-[3-(3-chlorophenyl)-5,8-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-[3-(3-chlorophenyl)-5,8-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(3-methylphenyl)acetamide
2-[3-(3-chlorophenyl)-5,8-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | E737-0302 |
| Compound Name: | 2-[3-(3-chlorophenyl)-5,8-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-(3-methylphenyl)acetamide |
| Molecular Weight: | 486.96 |
| Molecular Formula: | C27 H23 Cl N4 O3 |
| Smiles: | Cc1cccc(c1)NC(CN1C(N(C(c2c1c1cc(C)ccc1n2C)=O)c1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1977 |
| logD: | 5.1977 |
| logSw: | -5.4266 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.885 |
| InChI Key: | YYZHIJZJBOMCIO-UHFFFAOYSA-N |