4-{[4-(7-{4-[bis(4-formylphenyl)amino]phenyl}-2,1,3-benzothiadiazol-4-yl)phenyl](4-formylphenyl)amino}benzaldehyde

4-{[4-(7-{4-[bis(4-formylphenyl)amino]phenyl}-2,1,3-benzothiadiazol-4-yl)phenyl](4-formylphenyl)amino}benzaldehyde

Formula: C46H30N4O4S

SMILES: O=CC1=CC=C(C=C1)N(C1=CC=C(C=O)C=C1)C1=CC=C(C=C1)C1=CC=C(C2=NSN=C12)C1=CC=C(C=C1)N(C1=CC=C(C=O)C=C1)C1=CC=C(C=O)C=C1

IUPAC: 4-{[4-(7-{4-[bis(4-formylphenyl)amino]phenyl}-2,1,3-benzothiadiazol-4-yl)phenyl](4-formylphenyl)amino}benzaldehyde

InChI: InChI=1S/C46H30N4O4S/c51-27-31-1-13-37(14-2-31)49(38-15-3-32(28-52)4-16-38)41-21-9-35(10-22-41)43-25-26-44(46-45(43)47-55-48-46)36-11-23-42(24-12-36)50(39-17-5-33(29-53)6-18-39)40-19-7-34(30-54)8-20-40/h1-30H

Composition: C (75.19%), H (4.12%), N (7.62%), O (8.71%), S (4.36%)

Molar Mass: 734.83

Atom Count: 85

Heavy Atom Count: 55

Properties

Properties

Common Names	N/A
Aromatic Ring Count	8
Asymmetric Atom Count	0
Exact Mass	734.198776636
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	0
InChIKey	WJEWKNCAQBEGDE-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	219.47
Topological Polar Surface Area	100.54
Polarizability	84.99
Ring Count	8
Rotatable Bond Count	12

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C46H30N4O4S		Quote Only