4-chloro-N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)-3-nitrobenzamide

4-chloro-N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)-3-nitrobenzamide

Formula: C15H10ClN3O5S2

SMILES: CS(=O)(=O)C1=CC=C2N=C(NC(=O)C3=CC=C(Cl)C(=C3)[N+]([O-])=O)SC2=C1

IUPAC: 4-chloro-N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)-3-nitrobenzamide

InChI: InChI=1S/C15H10ClN3O5S2/c1-26(23,24)9-3-5-11-13(7-9)25-15(17-11)18-14(20)8-2-4-10(16)12(6-8)19(21)22/h2-7H,1H3,(H,17,18,20)

Composition: C (43.75%), H (2.45%), Cl (8.61%), N (10.20%), O (19.42%), S (15.57%)

Molar Mass: 411.83

Atom Count: 36

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	410.9750405
Formal Charge	0
FSP3	0.07
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	ULCMPMYCEZEQRT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	97.26
Topological Polar Surface Area	119.27
Polarizability	38.16
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H10ClN3O5S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00