Products 1224095-98-0

CAS 1224095-98-0 appears in our catalog under these names: Brilacidin, Brilacidin (PMX 30063), Brilacidin, 92.54%. Offered by: Chemat Brand, GLPBio, Biosynth, MedChemExpress. Available pack sizes: on request, 1mg, 10mg, 20mg, 5mg, 10 mg, 1 mg, 5 mg.

Structural formula: {0} (CAS {1})

4-N,6-N-bis[3-[5-(diaminomethylideneamino)pentanoylamino]-2-[(3R)-pyrrolidin-3-yl]oxy-5-(trifluoromethyl)phenyl]pyrimidine-4,6-dicarboxamide (CAS 1224095-98-0) is a chemical compound with the molecular formula C40H50F6N14O6 and a molecular weight of 936.9 g/mol. IUPAC name: 4-N,6-N-bis[3-[5-(diaminomethylideneamino)pentanoylamino]-2-[(3R)-pyrrolidin-3-yl]oxy-5-(trifluoromethyl)phenyl]pyrimidine-4,6-dicarboxamide. InChIKey: QPDYBCZNGUJZDK-DNQXCXABSA-N.

Identity
Molecular formulaC40H50F6N14O6
Molecular weight936.9 g/mol
IUPAC name4-N,6-N-bis[3-[5-(diaminomethylideneamino)pentanoylamino]-2-[(3R)-pyrrolidin-3-yl]oxy-5-(trifluoromethyl)phenyl]pyrimidine-4,6-dicarboxamide
InChIKeyQPDYBCZNGUJZDK-DNQXCXABSA-N
SMILESC1CNC[C@@H]1OC2=C(C=C(C=C2NC(=O)C3=CC(=NC=N3)C(=O)NC4=CC(=CC(=C4O[C@@H]5CCNC5)NC(=O)CCCCN=C(N)N)C(F)(F)F)C(F)(F)F)NC(=O)CCCCN=C(N)N

Computed by PubChem (NCBI)