1-(3-chlorophenyl)-3-(propan-2-yl)-1,5,6,7-tetrahydro-4H-indazol-4-one
Chemical Structure Depiction of
1-(3-chlorophenyl)-3-(propan-2-yl)-1,5,6,7-tetrahydro-4H-indazol-4-one
1-(3-chlorophenyl)-3-(propan-2-yl)-1,5,6,7-tetrahydro-4H-indazol-4-one
Compound characteristics
| Compound ID: | P774-0119 |
| Compound Name: | 1-(3-chlorophenyl)-3-(propan-2-yl)-1,5,6,7-tetrahydro-4H-indazol-4-one |
| Molecular Weight: | 288.77 |
| Molecular Formula: | C16 H17 Cl N2 O |
| Smiles: | CC(C)c1c2C(CCCc2n(c2cccc(c2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4301 |
| logD: | 4.4301 |
| logSw: | -4.7875 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 28.0032 |
| InChI Key: | BGIUXQKJUXLTDN-UHFFFAOYSA-N |