化合物产品

TZ9

CAS 登记号1002789-86-7
TZ9 chemical structure
主记录

TZ9

CAS
1002789-86-7
PubChem CID
7593228
SMILES
C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-]
分子式
C17H14N6O4
分子量
366.337
精确分子量
366.1077
InChI
InChI=1S/C17H14N6O4/c18-16-20-14(21-17(22-16)19-12-4-2-1-3-5-12)10-27-15(24)11-6-8-13(9-7-11)23(25)26/h1-9H,10H2,(H3,18,19,20,21,22)
InChIKey
RRRDZFQRNJTKHL-UHFFFAOYSA-N
LogP
2.4626
TPSA
146.16

名称与别名

  • 1002789-86-7
  • TZ9
  • TZ-9
  • SMI#9
  • CHEMBL3787660
  • C17H14N6O4
  • orb1706502
  • SMI# 9
  • SCHEMBL29450770
  • GLXC-04472
  • CQB78986
  • ZINC5259235
  • (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 4-nitrobenzoate
  • BDBM50468268
  • EX-A11016
  • MFCD28385849
  • ZINC05259235
  • AKOS030260471
  • AKOS040742795
  • CID7593228
  • CS-3536
  • NCGC00388157-02
  • AC-37871
  • DA-58839
  • HY-18643
  • MS-25855
  • B4861
  • J3.393.173E
  • A12811
  • F85085