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74787-95-4 | Thiourea, N-cyclohexyl-N-(2-hydroxyethyl)-N'-(1-phenylethyl)-
CAS No: 74787-95-4 Catalog No: AG005H9K MDL No:
Product Description
Catalog Number:
AG005H9K
Chemical Name:
Thiourea, N-cyclohexyl-N-(2-hydroxyethyl)-N'-(1-phenylethyl)-
CAS Number:
74787-95-4
Molecular Formula:
C17H26N2OS
Molecular Weight:
306.4661
IUPAC Name:
1-cyclohexyl-1-(2-hydroxyethyl)-3-(1-phenylethyl)thiourea
InChI:
InChI=1S/C17H26N2OS/c1-14(15-8-4-2-5-9-15)18-17(21)19(12-13-20)16-10-6-3-7-11-16/h2,4-5,8-9,14,16,20H,3,6-7,10-13H2,1H3,(H,18,21)
InChI Key:
CBDTXHCSAUDJES-UHFFFAOYSA-N
SMILES:
OCCN(C(=S)NC(c1ccccc1)C)C1CCCCC1
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.177g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
306.468g/mol
Monoisotopic Mass:
306.177g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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