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88964-05-0 | 2-Thiazolamine, 4-(chloromethyl)-N-(4,5-dihydro-1H-imidazol-2-yl)-
CAS No: 88964-05-0 Catalog No: AG0045X7 MDL No:
Product Description
Catalog Number:
AG0045X7
Chemical Name:
2-Thiazolamine, 4-(chloromethyl)-N-(4,5-dihydro-1H-imidazol-2-yl)-
CAS Number:
88964-05-0
Molecular Formula:
C7H9ClN4S
Molecular Weight:
216.6912
IUPAC Name:
4-(chloromethyl)-N-(4,5-dihydro-1H-imidazol-2-yl)-1,3-thiazol-2-amine
InChI:
InChI=1S/C7H9ClN4S/c8-3-5-4-13-7(11-5)12-6-9-1-2-10-6/h4H,1-3H2,(H2,9,10,11,12)
InChI Key:
MHWYLRBDRJOKKV-UHFFFAOYSA-N
SMILES:
ClCc1csc(n1)NC1=NCCN1
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.024g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.687g/mol
Monoisotopic Mass:
216.024g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
77.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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