[4-({1-[3-(carboxymethyl)adamantan-1-yl]-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl}amino)phenyl]acetic acid
Chemical Structure Depiction of
[4-({1-[3-(carboxymethyl)adamantan-1-yl]-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl}amino)phenyl]acetic acid
[4-({1-[3-(carboxymethyl)adamantan-1-yl]-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl}amino)phenyl]acetic acid
Compound characteristics
| Compound ID: | C719-0208 |
| Compound Name: | [4-({1-[3-(carboxymethyl)adamantan-1-yl]-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl}amino)phenyl]acetic acid |
| Molecular Weight: | 471.94 |
| Molecular Formula: | C24 H26 Cl N3 O5 |
| Smiles: | C1C2CC3(CC1CC(C2)(C3)N1C(C(=C(C=N1)Nc1ccc(CC(O)=O)cc1)[Cl])=O)CC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3619 |
| logD: | 0.2775 |
| logSw: | -3.5531 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.263 |
| InChI Key: | FGXCNCFIRSIOBL-UHFFFAOYSA-N |