Calindol hydrochloride 5mg

CAT: 0628-A24304-5Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0628-A24304-5Size:5 mg

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CAS Number

729610-18-8

Chemical Information

Calindol Hydrochloride

See also: Calindol hdyrochloride (annotation moved to).

CAS Number	729610-18-8
PubChem CID	23544608
IUPAC Name	(1R)-N-(1H-indol-2-ylmethyl)-1-naphthalen-1-ylethanamine;hydrochloride
Molecular Formula	C21H21ClN2
Molecular Weight	336.9
Topological Polar Surface Area	27.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Heavy Atom Count	24
Formal Charge	0
Complexity	382

SMILES

C[C@H](C1=CC=CC2=CC=CC=C21)NCC3=CC4=CC=CC=C4N3.Cl

InChI

InChI=1S/C21H20N2.ClH/c1-15(19-11-6-9-16-7-2-4-10-20(16)19)22-14-18-13-17-8-3-5-12-21(17)23-18;/h2-13,15,22-23H,14H2,1H3;1H/t15-;/m1./s1

InChIKey

KFILKQPBQZIRST-XFULWGLBSA-N

Chemical Structure

2D Structure

CAS: 729610-18-8

CID: 23544608

Formula: C21H21ClN2

MW: 336.9

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	336.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	336.1393264
Monoisotopic Mass	336.1393264
Topological Polar Surface Area	27.8 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	382
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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