主记录
AV-412 free base
- CAS
- 451492-95-8
- PubChem CID
- 9806229
- SMILES
- CC(C)(C#CC1=CC2=C(C=C1NC(=O)C=C)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)N4CCN(CC4)C
- 分子式
- C27H28ClFN6O
- 分子量
- 507.013
- 精确分子量
- 506.1997
- InChI
- InChI=1S/C27H28ClFN6O/c1-5-25(36)33-23-16-20-24(30-17-31-26(20)32-19-6-7-22(29)21(28)15-19)14-18(23)8-9-27(2,3)35-12-10-34(4)11-13-35/h5-7,14-17H,1,10-13H2,2-4H3,(H,33,36)(H,30,31,32)
- InChIKey
- ZAJXXUDARPGGOC-UHFFFAOYSA-N
- LogP
- 4.6679
- TPSA
- 73.39
名称与别名
- AV-412 free base
- 451492-95-8
- AV-412
- AV-412 (free base)
- UNII-41OXH4FE7B
- MP-412
- AV-412(freebase)
- MP-412 free base
- 41OXH4FE7B
- AV412(Free base)
- C27H28ClFN6O
- RefChem:115727
- AV412
- MFCD16038939
- CHEMBL2138625
- DTXSID10196403
- HMS3244M15
- orb1678998
- SCHEMBL1818495
- SCHEMBL29479075
- SCHEMBL29944737
- AV-412 free base;MP-412
- AV-412(MP-412)
- DTXCID80118894
- EX-A755
- SYN1012
- MP-312
- BCPP000375
- GLXC-07053
- HMS3244M16