ethyl 4-[2-(5,8-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 4-[2-(5,8-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)acetamido]benzoate
ethyl 4-[2-(5,8-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | C200-2990 |
| Compound Name: | ethyl 4-[2-(5,8-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)acetamido]benzoate |
| Molecular Weight: | 510.55 |
| Molecular Formula: | C29 H26 N4 O5 |
| Smiles: | CCOC(c1ccc(cc1)NC(CN1C(N(C(c2c1c1cc(C)ccc1n2C)=O)c1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6781 |
| logD: | 4.6781 |
| logSw: | -4.3152 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.639 |
| InChI Key: | QLMLNALGYCNYIE-UHFFFAOYSA-N |