AG009UBB

112282-24-3 | 2-(3,4-Dichlorophenyl)-1-(2-(pyrrolidin-1-ylmethyl)piperidin-1-yl)ethanone hydrochloride

AG009UBB

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CAS Number	112282-24-3
Catalog Number	AG009UBB(AGN-PC-0P38K3)
Chemical Name	2-(3,4-Dichlorophenyl)-1-(2-(pyrrolidin-1-ylmethyl)piperidin-1-yl)ethanone hydrochloride
IUPAC Name	2-(3,4-dichlorophenyl)-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanone;hydrochloride
InChI	InChI=1S/C18H24Cl2N2O.ClH/c19-16-7-6-14(11-17(16)20)12-18(23)22-10-2-1-5-15(22)13-21-8-3-4-9-21;/h6-7,11,15H,1-5,8-10,12-13H2;1H
InChI Key	NGVLSOWJSUUYDE-UHFFFAOYSA-N
MDL Number	MFCD00672679
Molecular Formula	C18H25Cl3N2O
Molecular Weight	391.7629
SMILES	ClC1=CC=C(CC(N2C(CN3CCCC3)CCCC2)=O)C=C1Cl.[H]Cl
Synonyms	1-(3,4-dichlorophenyl)acetyl-2-(1-pyrrolidinyl)methylpiperidine, BRL 52537, BRL-52537, BRL52537, BRL 52537 hydrochloride, 130497-33-5, 2-(3,4-Dichlorophenyl)-1-(2-(pyrrolidin-1-ylmethyl)piperidin-1-yl)ethanone hydrochloride, 112282-24-3, BRL 52537, Brl 52537 HCl, AK-57392, (+/-)-1-(3,4-Dichlorophenyl)acetyl-2-(1-pyrrolidinyl)methylpiperidine hydrochloride, 2-(3,4-DICHLOROPHENYL)-1-(2-(PYRROLIDIN-1-YLMETHYL)PIPERIDIN-1-YL)ETHANONE HCL, SR-01000076141, EU-0101141, BRL-52537 hydrochloride, MLS002153457, SCHEMBL8435659, CHEMBL1256835, CTK8C4721, KS-00000FTT, DTXSID00462129, BCP21081, EBD29079, Tox21_501141, ABP001017, ANW-72902, BN0592, MFCD00672679, AKOS015910291, API0009081, DS-1689, LP01141, MP-1898, KS-000024N2, NCGC00094407-01, NCGC00261826-01, 4CA-0320, BR-57392, QC-10222, SMR000326905, AB0069170, AX8118701, RT-011816, ST24027492, B 5559, J-005817, SR-01000076141-1, SR-01000076141-3, I14-40265, (+/-)-1-(3,4-Dichlorophenyl)acetyl-2-( 1-pyrrolidinyl)methylpiperidine hydrochloride, 2-(3,4-dichlorophenyl)-1-(2-(pyrrolidin-1-ylmethyl)piperidin-1-yl)ethan-1-one hydrochloride, 2-(3,4-dichlorophenyl)-1-{2-[(pyrrolidin-1-yl)methyl]piperidin-1-yl}ethan-1-one hydrochloride, cc-122, D03QZJ, D04YNW, CC-122 HCl, BRL-52537, CID11315337, CC-16057, Pleiotropic pathway modulator (oral, cancer), Celgene, Pleiotropic pathway modifiers (inflammatory disease), Celgene,

Complexity	401
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	390.103g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	391.761g/mol
Monoisotopic Mass	390.103g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	23.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number