1-(5-phenylpyridin-3-yl)-1,4-diazepane

1-(5-phenylpyridin-3-yl)-1,4-diazepane

CAS: 223796-38-1

Formula: C16H19N3

SMILES: C1CNCCN(C1)C1=CN=CC(=C1)C1=CC=CC=C1

IUPAC: 1-(5-phenylpyridin-3-yl)-1,4-diazepane

InChI: InChI=1S/C16H19N3/c1-2-5-14(6-3-1)15-11-16(13-18-12-15)19-9-4-7-17-8-10-19/h1-3,5-6,11-13,17H,4,7-10H2

Composition: C (75.85%), H (7.56%), N (16.59%)

Molar Mass: 253.349

Atom Count: 38

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	253.157897624
Formal Charge	0
FSP3	0.31
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	YAWZOEAWIFAGIV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	79.09
Topological Polar Surface Area	28.16
Polarizability	31.62
Ring Count	3
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	223796-38-1		$103.40-$157.63$103.40$157.63