CCG-203971 50mg

CAT: 0628-A16928-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0628-A16928-50Size:50 mg

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CAS Number

1443437-74-8

Chemical Information

Ccg-203971

CAS Number	1443437-74-8
PubChem CID	71681561
IUPAC Name	N-(4-chlorophenyl)-1-[3-(furan-2-yl)benzoyl]piperidine-3-carboxamide
Molecular Formula	C23H21ClN2O3
Molecular Weight	408.9
XLogP	4.1
Topological Polar Surface Area	62.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	29
Formal Charge	0
Complexity	578

SMILES

C1CC(CN(C1)C(=O)C2=CC=CC(=C2)C3=CC=CO3)C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H21ClN2O3/c24-19-8-10-20(11-9-19)25-22(27)18-6-2-12-26(15-18)23(28)17-5-1-4-16(14-17)21-7-3-13-29-21/h1,3-5,7-11,13-14,18H,2,6,12,15H2,(H,25,27)

InChIKey

HERLZBNILRVHQN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1443437-74-8

CID: 71681561

Formula: C23H21ClN2O3

MW: 408.9

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	408.9
XLogP3	4.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	408.1240702
Monoisotopic Mass	408.1240702
Topological Polar Surface Area	62.6 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	578
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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B4921-50	CCG 203971
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B4897-5.1	CCG-1423
HY-150040	CCG-273463
M23376-01	CCG-100602

CCG-203971 50mg

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