3-(3-chlorophenyl)-1-ethyl-5,8-dimethyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Chemical Structure Depiction of
3-(3-chlorophenyl)-1-ethyl-5,8-dimethyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
3-(3-chlorophenyl)-1-ethyl-5,8-dimethyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Compound characteristics
| Compound ID: | E737-0300 |
| Compound Name: | 3-(3-chlorophenyl)-1-ethyl-5,8-dimethyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione |
| Molecular Weight: | 367.83 |
| Molecular Formula: | C20 H18 Cl N3 O2 |
| Smiles: | CCN1C(N(C(c2c1c1cc(C)ccc1n2C)=O)c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1298 |
| logD: | 4.1298 |
| logSw: | -4.255 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.732 |
| InChI Key: | HWTCLPHHTFYSSY-UHFFFAOYSA-N |