Products 1622250-38-7

CAS 1622250-38-7 appears in our catalog under these names: CH1055, CH1055, 95.47%, CH1055, 95%. Offered by: GLPBio, MedChemExpress, Chemat. Available pack sizes: 5mg, 10 mg, 5 mg, 1 mg, 1mg.

CH1055
GLPBio
  • size: 5mg
  • Variants: 1
from 13262.47
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CH1055, 95.47%
MedChemExpress
  • size: 10 mg, 5 mg, 1 mg
  • Variants: 3
from 2924.98
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CH1055, 95%
Chemat
  • size: 1mg
  • Variants: 1
from 8949.20
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Structural formula: {0} (CAS {1})

3-[4-[4-(2-carboxyethyl)-N-[4-[8-[4-[4-(2-carboxyethyl)-N-[4-(2-carboxyethyl)phenyl]anilino]phenyl]-5lambda4,11-dithia-4,6,10,12-tetrazatricyclo[7.3.0.03,7]dodeca-1(12),2,4,5,7,9-hexaen-2-yl]phenyl]anilino]phenyl]propanoic acid (CAS 1622250-38-7) is a chemical compound with the molecular formula C54H44N6O8S2 and a molecular weight of 969.1 g/mol. IUPAC name: 3-[4-[4-(2-carboxyethyl)-N-[4-[8-[4-[4-(2-carboxyethyl)-N-[4-(2-carboxyethyl)phenyl]anilino]phenyl]-5lambda4,11-dithia-4,6,10,12-tetrazatricyclo[7.3.0.03,7]dodeca-1(12),2,4,5,7,9-hexaen-2-yl]phenyl]anilino]phenyl]propanoic acid. InChIKey: LTJDYGCWCCRPBZ-UHFFFAOYSA-N.

Identity
Molecular formulaC54H44N6O8S2
Molecular weight969.1 g/mol
IUPAC name3-[4-[4-(2-carboxyethyl)-N-[4-[8-[4-[4-(2-carboxyethyl)-N-[4-(2-carboxyethyl)phenyl]anilino]phenyl]-5lambda4,11-dithia-4,6,10,12-tetrazatricyclo[7.3.0.03,7]dodeca-1(12),2,4,5,7,9-hexaen-2-yl]phenyl]anilino]phenyl]propanoic acid
InChIKeyLTJDYGCWCCRPBZ-UHFFFAOYSA-N
SMILESC1=CC(=CC=C1CCC(=O)O)N(C2=CC=C(C=C2)CCC(=O)O)C3=CC=C(C=C3)C4=C5C(=C(C6=NSN=C46)C7=CC=C(C=C7)N(C8=CC=C(C=C8)CCC(=O)O)C9=CC=C(C=C9)CCC(=O)O)N=S=N5

Computed by PubChem (NCBI)

Synonyms: BPA-Bbtzbpt, orb2566640