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1-(4-methoxyphenyl)-6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indole hydrochloride

1-(4-methoxyphenyl)-6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indole hydrochloride

CAS: 1431962-16-1

Formula: C19H21ClN2O

SMILES: Cl.COC1=CC=C(C=C1)C1NCCC2=C1NC1=CC=C(C)C=C21

IUPAC: 1-(4-methoxyphenyl)-6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indole hydrochloride

InChI: InChI=1/C19H20N2O.ClH/c1-12-3-8-17-16(11-12)15-9-10-20-18(19(15)21-17)13-4-6-14(22-2)7-5-13;/h3-8,11,18,20-21H,9-10H2,1-2H3;1H

Composition: C (69.40%), H (6.44%), Cl (10.78%), N (8.52%), O (4.87%)

Molar Mass: 328.84

Atom Count: 44

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 328.134241
Formal Charge 0
FSP3 0.26
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey DOLVQVVMHKSSGY-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 89.37
Topological Polar Surface Area 37.05
Polarizability 35.73
Ring Count 4
Rotatable Bond Count 2

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Kinentia Biosciences LLC
Purity LeadTime CAS PacketSize UnitPrice
95% <14 Days 1431962-16-1 $306.18$306.18
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Crea-Chim UAB
Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 1431962-16-1 $75.40$75.40
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