sulconazole nitrate

sulconazole nitrate

CAS: 82382-23-8

Formula: C18H16Cl3N3O3S

SMILES: O[N+]([O-])=O.ClC1=CC=C(CSC(CN2C=CN=C2)C2=CC=C(Cl)C=C2Cl)C=C1

IUPAC: 1-(2-{[(4-chlorophenyl)methyl]sulfanyl}-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole; nitric acid

InChI: InChI=1/C18H15Cl3N2S.HNO3/c19-14-3-1-13(2-4-14)11-24-18(10-23-8-7-22-12-23)16-6-5-15(20)9-17(16)21;2-1(3)4/h1-9,12,18H,10-11H2;(H,2,3,4)

Composition: C (46.92%), H (3.50%), Cl (23.08%), N (9.12%), O (10.42%), S (6.96%)

Molar Mass: 460.75

Atom Count: 44

Heavy Atom Count: 28

Properties

Properties

Common Names	sulconazole nitrate
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	458.9977957
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	CRKGMGQUHDNAPB-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	104.37
Topological Polar Surface Area	17.82
Polarizability	40.44
Ring Count	3
Rotatable Bond Count	6

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Purity	LeadTime	CAS		UnitPrice
99%	<10 Days	82382-23-8		Quote Only