N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{3-[(4-methoxyphenyl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{3-[(4-methoxyphenyl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{3-[(4-methoxyphenyl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
Compound characteristics
| Compound ID: | F394-0491 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{3-[(4-methoxyphenyl)methyl]-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide |
| Molecular Weight: | 484.6 |
| Molecular Formula: | C29 H32 N4 O3 |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(Cc3ccc(cc3)OC)C=N1)=O)n2CC(NCCC1CCCCC=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.232 |
| logD: | 4.232 |
| logSw: | -4.3128 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.977 |
| InChI Key: | CBLAQLYCRUVZJY-UHFFFAOYSA-N |