主记录
AHR antagonist 1
- CAS
- 2162982-11-6
- PubChem CID
- 132168144
- SMILES
- C[C@@H](CO)NC(=O)C1=CC(=NN(C1=O)C2=CC(=CC=C2)F)C3=CC=C(C=C3)Cl
- 分子式
- C20H17ClFN3O3
- 分子量
- 401.825
- 精确分子量
- 401.0942
- InChI
- InChI=1S/C20H17ClFN3O3/c1-12(11-26)23-19(27)17-10-18(13-5-7-14(21)8-6-13)24-25(20(17)28)16-4-2-3-15(22)9-16/h2-10,12,26H,11H2,1H3,(H,23,27)/t12-/m0/s1
- InChIKey
- RFGRNBWAUZSMBN-LBPRGKRZSA-N
- LogP
- 2.8026
- TPSA
- 84.22
名称与别名
- AHR antagonist 1
- BAY-218
- 2162982-11-6
- C20H17ClFN3O3
- orb1301645
- SCHEMBL19642453
- SCHEMBL29727528
- BAY 218
- MFCD31736303
- GLXC-21622
- BAY2335218(BAY-218)
- BCP31105
- EX-A3110
- MLD98211
- s8842
- ZB1593
- AKOS037649076
- EBC-155045
- (S)-6-(4-Chlorophenyl)-2-(3-fluorophenyl)-N-(1-hydroxypropan-2-yl)-3-oxo-2,3-dihydropyridazine-4-carboxamide
- BAY-2335218
- 6-(4-chlorophenyl)-2-(3-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-oxo-2,3-dihydropyridazine-4-carboxamide
- AC-31591
- BAY2335218; BAY-218
- BS-16509
- DA-71311
- HY-111449
- BAY-218; BAY 218; BAY218
- CS-0040922
- N16941
- EN300-1719395