5-[(3-chlorocyclohexyl)amino]benzo[c]2,6-naphthyridine-8-carboxylic acid

5-[(3-chlorocyclohexyl)amino]benzo[c]2,6-naphthyridine-8-carboxylic acid

CAS: 1309357-15-0

Formula: C19H18ClN3O2

SMILES: OC(=O)C1=CC2=C(C=C1)C1=C(C=CN=C1)C(NC1CCCC(Cl)C1)=N2

IUPAC: 5-[(3-chlorocyclohexyl)amino]benzo[c]2,6-naphthyridine-8-carboxylic acid

InChI: InChI=1/C19H18ClN3O2/c20-12-2-1-3-13(9-12)22-18-15-6-7-21-10-16(15)14-5-4-11(19(24)25)8-17(14)23-18/h4-8,10,12-13H,1-3,9H2,(H,22,23)(H,24,25)

Composition: C (64.14%), H (5.10%), Cl (9.96%), N (11.81%), O (8.99%)

Molar Mass: 355.82

Atom Count: 43

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	2
Exact Mass	355.1087545
Formal Charge	0
FSP3	0.32
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	ZXPPUNRSOYMXSG-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	97.73
Topological Polar Surface Area	75.11
Polarizability	39.15
Ring Count	4
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
99%	<5 Days	1309357-15-0		$162.67-$634.28$162.67$213.11$634.28