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(2Z)-N-(4-{[1,1'-biphenyl]-4-yl}-5-methyl-1,3-thiazol-2-yl)-7-hydroxy-2-[(3-methylphenyl)imino]chromene-3-carboxamide

(2Z)-N-(4-{[1,1'-biphenyl]-4-yl}-5-methyl-1,3-thiazol-2-yl)-7-hydroxy-2-[(3-methylphenyl)imino]chromene-3-carboxamide

Formula: C33H25N3O3S

SMILES: CC1=C(N=C(NC(=O)C2=CC3=CC=C(O)C=C3OC2=N/C2=CC(C)=CC=C2)S1)C1=CC=C(C=C1)C1=CC=CC=C1

IUPAC: (2Z)-N-(4-{[1,1'-biphenyl]-4-yl}-5-methyl-1,3-thiazol-2-yl)-7-hydroxy-2-[(3-methylphenyl)imino]-2H-chromene-3-carboxamide

InChI: InChI=1S/C33H25N3O3S/c1-20-7-6-10-26(17-20)34-32-28(18-25-15-16-27(37)19-29(25)39-32)31(38)36-33-35-30(21(2)40-33)24-13-11-23(12-14-24)22-8-4-3-5-9-22/h3-19,37H,1-2H3,(H,35,36,38)/b34-32-

Composition: C (72.91%), H (4.64%), N (7.73%), O (8.83%), S (5.90%)

Molar Mass: 543.64

Atom Count: 65

Heavy Atom Count: 40

Properties
Properties
Common Names N/A
Aromatic Ring Count 6
Asymmetric Atom Count 0
Exact Mass 543.161662851
Formal Charge 0
FSP3 0.06
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey YMBGVIFFUYFLQK-YJKCNMNRSA-N
Lipinski's Rule of Five
Molar Refractivity 161.31
Topological Polar Surface Area 83.81
Polarizability 62.34
Ring Count 6
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C33H25N3O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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