3-[(4-chlorophenyl)methyl]-2-methyl-11-pentyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]-2-methyl-11-pentyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
3-[(4-chlorophenyl)methyl]-2-methyl-11-pentyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Compound characteristics
| Compound ID: | IB08-1308 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]-2-methyl-11-pentyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one |
| Molecular Weight: | 445.95 |
| Molecular Formula: | C25 H24 Cl N5 O |
| Smiles: | CCCCCn1c2c(C(N(Cc3ccc(cc3)[Cl])C(C)=N2)=O)c2c1nc1ccccc1n2 |
| Stereo: | ACHIRAL |
| logP: | 6.27 |
| logD: | 6.27 |
| logSw: | -6.12 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 65.26 |
| InChI Key: | RAQIMSZXKZKHFM-UHFFFAOYSA-N |