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827591-38-8 | Thiourea,N-(4-methyl-1-piperazinyl)-N'-(2-methylpropyl)-
CAS No: 827591-38-8 Catalog No: AG004Z0J MDL No:
Product Description
Catalog Number:
AG004Z0J
Chemical Name:
Thiourea,N-(4-methyl-1-piperazinyl)-N'-(2-methylpropyl)-
CAS Number:
827591-38-8
Molecular Formula:
C10H22N4S
Molecular Weight:
230.3735
IUPAC Name:
1-(4-methylpiperazin-1-yl)-1-(2-methylpropyl)thiourea
InChI:
InChI=1S/C10H22N4S/c1-9(2)8-14(10(11)15)13-6-4-12(3)5-7-13/h9H,4-8H2,1-3H3,(H2,11,15)
InChI Key:
PRYHJNNSVZCRKI-UHFFFAOYSA-N
SMILES:
CC(CN(N1CCN(CC1)C)C(=S)N)C
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.157g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.374g/mol
Monoisotopic Mass:
230.157g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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