6-[(3-chlorophenyl)methyl]-3,4-dimethyl[1,2]oxazolo[3,4-d]pyridazin-7(6H)-one
Chemical Structure Depiction of
6-[(3-chlorophenyl)methyl]-3,4-dimethyl[1,2]oxazolo[3,4-d]pyridazin-7(6H)-one
6-[(3-chlorophenyl)methyl]-3,4-dimethyl[1,2]oxazolo[3,4-d]pyridazin-7(6H)-one
Compound characteristics
| Compound ID: | F279-0405 |
| Compound Name: | 6-[(3-chlorophenyl)methyl]-3,4-dimethyl[1,2]oxazolo[3,4-d]pyridazin-7(6H)-one |
| Molecular Weight: | 289.72 |
| Molecular Formula: | C14 H12 Cl N3 O2 |
| Smiles: | CC1c2c(C(N(Cc3cccc(c3)[Cl])N=1)=O)noc2C |
| Stereo: | ACHIRAL |
| logP: | 2.5691 |
| logD: | 2.5691 |
| logSw: | -3.4408 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.962 |
| InChI Key: | KYHDZVCKQRERBZ-UHFFFAOYSA-N |