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(2Z)-N-(4-{[1,1'-biphenyl]-4-yl}-5-ethyl-1,3-thiazol-2-yl)-6-chloro-2-[(4-methylphenyl)imino]chromene-3-carboxamide

(2Z)-N-(4-{[1,1'-biphenyl]-4-yl}-5-ethyl-1,3-thiazol-2-yl)-6-chloro-2-[(4-methylphenyl)imino]chromene-3-carboxamide

Formula: C34H26ClN3O2S

SMILES: CCC1=C(N=C(NC(=O)C2=CC3=CC(Cl)=CC=C3OC2=N/C2=CC=C(C)C=C2)S1)C1=CC=C(C=C1)C1=CC=CC=C1

IUPAC: (2Z)-N-(4-{[1,1'-biphenyl]-4-yl}-5-ethyl-1,3-thiazol-2-yl)-6-chloro-2-[(4-methylphenyl)imino]-2H-chromene-3-carboxamide

InChI: InChI=1S/C34H26ClN3O2S/c1-3-30-31(24-13-11-23(12-14-24)22-7-5-4-6-8-22)37-34(41-30)38-32(39)28-20-25-19-26(35)15-18-29(25)40-33(28)36-27-16-9-21(2)10-17-27/h4-20H,3H2,1-2H3,(H,37,38,39)/b36-33-

Composition: C (70.88%), H (4.55%), Cl (6.15%), N (7.29%), O (5.55%), S (5.56%)

Molar Mass: 576.11

Atom Count: 67

Heavy Atom Count: 41

Properties
Properties
Common Names N/A
Aromatic Ring Count 6
Asymmetric Atom Count 0
Exact Mass 575.143426
Formal Charge 0
FSP3 0.09
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey QJLSGPCRUZFDJQ-NECWGFRUSA-N
Lipinski's Rule of Five
Molar Refractivity 168.65
Topological Polar Surface Area 63.58
Polarizability 65.42
Ring Count 6
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C34H26ClN3O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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