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73790-80-4

73790-80-4 | N-METHYL-2-METHYLSULFANYL-N-[3-(PIPERIDIN-1-YL)PROPYL]ANILINE

CAS No: 73790-80-4 Catalog No: AG005BCK MDL No:

Product Description

Catalog Number:
AG005BCK
Chemical Name:
N-METHYL-2-METHYLSULFANYL-N-[3-(PIPERIDIN-1-YL)PROPYL]ANILINE
CAS Number:
73790-80-4
Molecular Formula:
C16H26N2S
Molecular Weight:
278.4560
IUPAC Name:
N-methyl-2-methylsulfanyl-N-(3-piperidin-1-ylpropyl)aniline
InChI:
InChI=1S/C16H26N2S/c1-17(15-9-4-5-10-16(15)19-2)11-8-14-18-12-6-3-7-13-18/h4-5,9-10H,3,6-8,11-14H2,1-2H3
InChI Key:
XSTJZSWXHWOVAA-UHFFFAOYSA-N
SMILES:
CSc1ccccc1N(CCCN1CCCCC1)C

Properties

Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.182g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.458g/mol
Monoisotopic Mass:
278.182g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
31.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

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