(4-chlorophenyl){4-[3-(3-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
(4-chlorophenyl){4-[3-(3-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}methanone
(4-chlorophenyl){4-[3-(3-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | V024-0188 |
| Compound Name: | (4-chlorophenyl){4-[3-(3-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 513 |
| Molecular Formula: | C28 H25 Cl N6 O2 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)c1nnc2c3ccccc3nc(N3CCCN(CC3)C(c3ccc(cc3)[Cl])=O)n12 |
| Stereo: | ACHIRAL |
| logP: | 5.2309 |
| logD: | 5.1821 |
| logSw: | -5.8672 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.324 |
| InChI Key: | JBBFLQWOJWBFNZ-UHFFFAOYSA-N |