2,5-bis({3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)cyclopentan-1-one
Chemical Structure Depiction of
2,5-bis({3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)cyclopentan-1-one
2,5-bis({3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)cyclopentan-1-one
Compound characteristics
| Compound ID: | C151-0683 |
| Compound Name: | 2,5-bis({3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)cyclopentan-1-one |
| Molecular Weight: | 536.67 |
| Molecular Formula: | C33 H36 N4 O3 |
| Smiles: | Cc1cc(C)n(Cc2cc(\C=C3/CC/C(=C\c4ccc(c(Cn5c(C)cc(C)n5)c4)OC)C3=O)ccc2OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.453 |
| logD: | 4.4528 |
| logSw: | -4.4308 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.132 |
| InChI Key: | SXQVAPWMAXXVDZ-UHFFFAOYSA-N |