{4-[3-(methoxymethyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}(phenyl)methanone
Chemical Structure Depiction of
{4-[3-(methoxymethyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}(phenyl)methanone
{4-[3-(methoxymethyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | V022-6857 |
| Compound Name: | {4-[3-(methoxymethyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}(phenyl)methanone |
| Molecular Weight: | 416.48 |
| Molecular Formula: | C23 H24 N6 O2 |
| Salt: | not_available |
| Smiles: | COCc1nnc2c3ccccc3nc(N3CCCN(CC3)C(c3ccccc3)=O)n12 |
| Stereo: | ACHIRAL |
| logP: | 2.2423 |
| logD: | 2.2282 |
| logSw: | -2.3988 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 59.452 |
| InChI Key: | MARWEBNXRKTRGU-UHFFFAOYSA-N |