N-[5-[[[5-(1,1-Dimethylethyl)-2-oxazolyl]methyl]thio]-2-thiazolyl]-4-piperidinecarboxamide L-tartaric acid salt (2:1) supplier

Name
SNS-032
EINECS
CAS No. 345627-92-1
Density
Solubility
Melting Point
Formula C₁₇H₂₄N₄O₂S₂^.1/2(C₄H₆O₆)
Boiling Point
Molecular Weight 910.28
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms SNS-032;
PSA 382.24000
LogP 5.99900

N-[5-[[[5-(1,1-Dimethylethyl)-2-oxazolyl]methyl]thio]-2-thiazolyl]-4-piperidinecarboxamide L-tartaric acid salt (2:1) Specification

The N-[5-[[[5-(1,1-Dimethylethyl)-2-oxazolyl]methyl]thio]-2-thiazolyl]-4-piperidinecarboxamide L-tartaric acid salt (2:1), with CAS registry number 345627-92-1, has the systematic name of N-(5-{[(5-tert-butyl-1,3-oxazol-2-yl)methyl]sulfanyl}-1,3-thiazol-2-yl)piperidine-4-carboxamide 2,3-dihydroxybutanedioate (2:1) (salt).

Physical properties about this chemical are: (1)ACD/LogP: 2.79; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 6; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 116.01 Å².

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc2ncc(SCc1ncc(o1)C(C)(C)C)s2)C3CCNCC3.O=C(O)[C@H](O)[C@@H](O)C(=O)O.O=C(Nc2ncc(SCc1ncc(o1)C(C)(C)C)s2)C3CCNCC3
(2)InChI: InChI=1/2C17H24N4O2S2.C4H6O6/c2*1-17(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;5-1(3(7)8)2(6)4(9)10/h2*8-9,11,18H,4-7,10H2,1-3H3,(H,20,21,22);1-2,5-6H,(H,7,8)(H,9,10)/t;;1-,2-/m..1/s1
(3)InChIKey: VWFVZMKHYHIITN-CEAXSRTFBG
(4)Std. InChI: InChI=1S/2C17H24N4O2S2.C4H6O6/c2*1-17(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;5-1(3(7)8)2(6)4(9)10/h2*8-9,11,18H,4-7,10H2,1-3H3,(H,20,21,22);1-2,5-6H,(H,7,8)(H,9,10)/t;;1-,2-/m..1/s1
(5)Std. InChIKey: VWFVZMKHYHIITN-CEAXSRTFSA-N

Product Name

SNS-032

N-[5-[[[5-(1,1-Dimethylethyl)-2-oxazolyl]methyl]thio]-2-thiazolyl]-4-piperidinecarboxamide L-tartaric acid salt (2:1) Specification

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