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Home > Thiazole > 1376372-41-6
1376372-41-6 | 1-{[2-(1-methoxyethyl)-1,3-thiazol-4-yl]methyl}-1,4-diazepane
CAS No: 1376372-41-6 Catalog No: AG019YRM MDL No:MFCD22196506
Product Description
Catalog Number:
AG019YRM
Chemical Name:
1-{[2-(1-methoxyethyl)-1,3-thiazol-4-yl]methyl}-1,4-diazepane
CAS Number:
1376372-41-6
Molecular Formula:
C12H21N3OS
Molecular Weight:
255.3796
MDL Number:
MFCD22196506
IUPAC Name:
4-(1,4-diazepan-1-ylmethyl)-2-(1-methoxyethyl)-1,3-thiazole
InChI:
InChI=1S/C12H21N3OS/c1-10(16-2)12-14-11(9-17-12)8-15-6-3-4-13-5-7-15/h9-10,13H,3-8H2,1-2H3
InChI Key:
KUKYVKYUPJHOOT-UHFFFAOYSA-N
SMILES:
COC(c1scc(n1)CN1CCNCCC1)C
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.141g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.38g/mol
Monoisotopic Mass:
255.141g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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