BMS-387032 hydrochloride

CAT: 0862-GW8214-1mgSize: 1 mgDry Ice: NoHazardous: No

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CAT#:0862-GW8214-1mgSize:1 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

345627-90-9

Storage Conditions

+4°C

Hazardous Class

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Chemical Information

N-[5-[[[5-(1,1-Dimethylethyl)-2-oxazolyl]methyl]thio]-2-thiazolyl]-4-piperidinecarboxamide hydrochloride

CAS Number	345627-90-9
PubChem CID	9823239
IUPAC Name	N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride
Molecular Formula	C17H25ClN4O2S2
Molecular Weight	417.0
Topological Polar Surface Area	134
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Heavy Atom Count	26
Formal Charge	0
Complexity	454

SMILES

CC(C)(C)C1=CN=C(O1)CSC2=CN=C(S2)NC(=O)C3CCNCC3.Cl

InChI

InChI=1S/C17H24N4O2S2.ClH/c1-17(2,3)12-8-19-13(23-12)10-24-14-9-20-16(25-14)21-15(22)11-4-6-18-7-5-11;/h8-9,11,18H,4-7,10H2,1-3H3,(H,20,21,22);1H

InChIKey

PKCYFIUOIGVHLX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 345627-90-9

CID: 9823239

Formula: C17H25ClN4O2S2

MW: 417.0

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	417.0
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Exact Mass	416.1107461
Monoisotopic Mass	416.1107461
Topological Polar Surface Area	134 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	454
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes