2-[3-(3-chlorophenyl)-8-methoxy-5-methyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[3-(3-chlorophenyl)-8-methoxy-5-methyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-[(oxolan-2-yl)methyl]acetamide
2-[3-(3-chlorophenyl)-8-methoxy-5-methyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | E737-0935 |
| Compound Name: | 2-[3-(3-chlorophenyl)-8-methoxy-5-methyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 496.95 |
| Molecular Formula: | C25 H25 Cl N4 O5 |
| Smiles: | Cn1c2C(N(C(N(CC(NCC3CCCO3)=O)c2c2cc(ccc12)OC)=O)c1cccc(c1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4413 |
| logD: | 2.4413 |
| logSw: | -3.4238 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.405 |
| InChI Key: | WJCDAFUVTAYZTE-GOSISDBHSA-N |