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BMS-3870032

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Name

BMS-3870032

EINECS N/A
CAS No. 345627-80-7 Density 1.288 g/cm3
PSA 133.59000 LogP 4.06080
Solubility N/A Melting Point 171-173 °C
Formula C17H24N4O2S2 Boiling Point N/A
Molecular Weight 380.535 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 345627-80-7 (N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]piperidine-4-carboxamide) Hazard Symbols N/A
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;

Article Data 3

BMS-3870032 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  

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