8-methoxy-5-methyl-1-(3-methylbutyl)-3-phenyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Chemical Structure Depiction of
8-methoxy-5-methyl-1-(3-methylbutyl)-3-phenyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
8-methoxy-5-methyl-1-(3-methylbutyl)-3-phenyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Compound characteristics
| Compound ID: | E737-1145 |
| Compound Name: | 8-methoxy-5-methyl-1-(3-methylbutyl)-3-phenyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C23 H25 N3 O3 |
| Smiles: | CC(C)CCN1C(N(C(c2c1c1cc(ccc1n2C)OC)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2178 |
| logD: | 4.2178 |
| logSw: | -4.2452 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.529 |
| InChI Key: | QBVDMYPRIHCRHF-UHFFFAOYSA-N |