5-(4-bromobenzenesulfonyl)-4-phenyl-1,2,3-thiadiazole

5-(4-bromobenzenesulfonyl)-4-phenyl-1,2,3-thiadiazole

CAS: 338398-40-6

Formula: C14H9BrN2O2S2

SMILES: BrC1=CC=C(C=C1)S(=O)(=O)C1=C(N=NS1)C1=CC=CC=C1

IUPAC: 5-(4-bromobenzenesulfonyl)-4-phenyl-1,2,3-thiadiazole

InChI: InChI=1S/C14H9BrN2O2S2/c15-11-6-8-12(9-7-11)21(18,19)14-13(16-17-20-14)10-4-2-1-3-5-10/h1-9H

Composition: C (44.10%), H (2.38%), Br (20.96%), N (7.35%), O (8.39%), S (16.82%)

Molar Mass: 381.26

Atom Count: 30

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	379.928883
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	CFXKILGZFDHRKV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	85.44
Topological Polar Surface Area	59.92
Polarizability	35.06
Ring Count	3
Rotatable Bond Count	3

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