(3-{5-chloro-4-[(naphthalen-1-yl)amino]-6-oxopyridazin-1(6H)-yl}adamantan-1-yl)acetic acid
Chemical Structure Depiction of
(3-{5-chloro-4-[(naphthalen-1-yl)amino]-6-oxopyridazin-1(6H)-yl}adamantan-1-yl)acetic acid
(3-{5-chloro-4-[(naphthalen-1-yl)amino]-6-oxopyridazin-1(6H)-yl}adamantan-1-yl)acetic acid
Compound characteristics
| Compound ID: | C719-0205 |
| Compound Name: | (3-{5-chloro-4-[(naphthalen-1-yl)amino]-6-oxopyridazin-1(6H)-yl}adamantan-1-yl)acetic acid |
| Molecular Weight: | 463.96 |
| Molecular Formula: | C26 H26 Cl N3 O3 |
| Smiles: | C1C2CC3(CC1CC(C2)(C3)N1C(C(=C(C=N1)Nc1cccc2ccccc12)[Cl])=O)CC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9126 |
| logD: | 2.1459 |
| logSw: | -4.8506 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.91 |
| InChI Key: | ZWTRZPPDCDUROL-UHFFFAOYSA-N |