Cas no 660423-57-4 (4-Pyridazinecarboxylic acid, 3,5-diphenyl-, methyl ester)
660423-57-4 structure
Product Name:4-Pyridazinecarboxylic acid, 3,5-diphenyl-, methyl ester
CAS No:660423-57-4
MF:C18H14N2O2
MW:290.315964221954
CID:1707368
PubChem ID:10108275
Update Time:2025-04-21
4-Pyridazinecarboxylic acid, 3,5-diphenyl-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 4-Pyridazinecarboxylic acid, 3,5-diphenyl-, methyl ester
- HICZHPFZMDTJBP-UHFFFAOYSA-N
- BDBM50173672
- 3,5-Diphenyl-pyridazine-4-carboxylic acid methyl ester
- GABRA5-agonist-6
- DB-158364
- Methyl 3,5-diphenylpyridazine-4-carboxylate
- CHEMBL364740
- SCHEMBL2652800
- 660423-57-4
- GLXC-04023
-
- Inchi： 1S/C18H14N2O2/c1-22-18(21)16-15(13-8-4-2-5-9-13)12-19-20-17(16)14-10-6-3-7-11-14/h2-12H,1H3
- InChI Key： HICZHPFZMDTJBP-UHFFFAOYSA-N
- SMILES： O(C)C(C1=C(C2C=CC=CC=2)N=NC=C1C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 290.10562
- Monoisotopic Mass: 290.105527694g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 362
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3
- Topological Polar Surface Area: 52.1?2
Experimental Properties
- PSA: 52.08
4-Pyridazinecarboxylic acid, 3,5-diphenyl-, methyl ester Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Xiao Liu,Jun Xu,Yinyun Lv,Wenyu Wu,Weisheng Liu,Yu Tang Dalton Trans., 2013,42, 9840-9846
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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