CAS No.345627-80-7,N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]piperidine-4-carboxamide Suppliers

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Basic Information

Molecular Structure:
CAS No.:	345627-80-7
Name:	N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]piperidine-4-carboxamide
Article Data:	3

Formula:	C₁₇H₂₄N₄O₂S₂
Molecular Weight:	380.535
Synonyms:	N-[5-[[(5-tert-Butyloxazol-2-yl)methyl]thio]thiazol-2-yl]piperidine-4-carboxamide;N-[5-[[[5-(1,1-Dimethylethyl)-2-oxazolyl]methyl]thio]-2-thiazolyl]-4-piperidinecarboxamide;SNS 032;
Density:	1.288 g/cm³
Melting Point:	171-173 °C
PSA:	133.59000
LogP:	4.06080

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Specification

The N-[5-[(5-tert-Butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]piperidine-4-carboxamide with the CAS number 345627-80-7 is also called 4-Piperidinecarboxamide,N-[5-[[[5-(1,1-dimethylethyl)-2-oxazolyl]methyl]thio]-2-thiazolyl]-. Its molecular formula is C₁₇H₂₄N₄O₂S₂. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 2.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.28; (4)ACD/LogD (pH 7.4): 0.26; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 2.31; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 116.01 Å²; (13)Index of Refraction: 1.606; (14)Molar Refractivity: 101.98 cm³; (15)Molar Volume: 295.4 cm³; (16)Polarizability: 40.42×10^-24cm³; (17)Surface Tension: 60.6 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc2ncc(SCc1ncc(o1)C(C)(C)C)s2)C3CCNCC3
(2)InChI: InChI=1/C17H24N4O2S2/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)
(3)InChIKey: OUSFTKFNBAZUKL-UHFFFAOYAE