2-(4-methoxyphenyl)-1-{4-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-methoxyphenyl)-1-{4-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}ethan-1-one
2-(4-methoxyphenyl)-1-{4-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V025-1512 |
| Compound Name: | 2-(4-methoxyphenyl)-1-{4-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}ethan-1-one |
| Molecular Weight: | 506.61 |
| Molecular Formula: | C30 H30 N6 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccccc1c1nnc2c3ccccc3nc(N3CCCN(CC3)C(Cc3ccc(cc3)OC)=O)n12 |
| Stereo: | ACHIRAL |
| logP: | 4.9209 |
| logD: | 4.8049 |
| logSw: | -4.8582 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.797 |
| InChI Key: | IUDNNCUMXDPCDM-UHFFFAOYSA-N |