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88723-82-4 | Guanidine, [4-[2-[(4-phenylbutyl)amino]-1H-imidazol-4-yl]-2-thiazolyl]-
CAS No: 88723-82-4 Catalog No: AG0045N8 MDL No:
Product Description
Catalog Number:
AG0045N8
Chemical Name:
Guanidine, [4-[2-[(4-phenylbutyl)amino]-1H-imidazol-4-yl]-2-thiazolyl]-
CAS Number:
88723-82-4
Molecular Formula:
C17H21N7S
Molecular Weight:
355.4605
IUPAC Name:
2-[4-[2-(4-phenylbutylamino)-1H-imidazol-5-yl]-1,3-thiazol-2-yl]guanidine
InChI:
InChI=1S/C17H21N7S/c18-15(19)24-17-23-14(11-25-17)13-10-21-16(22-13)20-9-5-4-8-12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H2,20,21,22)(H4,18,19,23,24)
InChI Key:
PPYRSEOJTNRQMB-UHFFFAOYSA-N
SMILES:
NC(=N)Nc1scc(n1)c1c[nH]c(n1)NCCCCc1ccccc1
Properties
Complexity:
423
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.158g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
355.464g/mol
Monoisotopic Mass:
355.158g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
146A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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