N-(2-methyl-5-nitrophenyl)-4-(pyridin-3-yl)-1,3-thiazol-2-amine

N-(2-methyl-5-nitrophenyl)-4-(pyridin-3-yl)-1,3-thiazol-2-amine

CAS: 1143459-81-7

Formula: C15H12N4O2S

SMILES: CC1=C(NC2=NC(=CS2)C2=CC=CN=C2)C=C(C=C1)[N+]([O-])=O

IUPAC: N-(2-methyl-5-nitrophenyl)-4-(pyridin-3-yl)-1,3-thiazol-2-amine

InChI: InChI=1S/C15H12N4O2S/c1-10-4-5-12(19(20)21)7-13(10)17-15-18-14(9-22-15)11-3-2-6-16-8-11/h2-9H,1H3,(H,17,18)

Composition: C (57.68%), H (3.87%), N (17.94%), O (10.24%), S (10.26%)

Molar Mass: 312.35

Atom Count: 34

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	312.068096816
Formal Charge	0
FSP3	0.07
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	SDDODIFTQFSODB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	83.19
Topological Polar Surface Area	80.95
Polarizability	32.51
Ring Count	3
Rotatable Bond Count	4

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