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1105188-72-4 | 4,6-Difluoro-N-(3-morpholinopropyl)benzo[d]thiazol-2-amine
CAS No: 1105188-72-4 Catalog No: AG01FMGI MDL No:MFCD11987011
Product Description
Catalog Number:
AG01FMGI
Chemical Name:
4,6-Difluoro-N-(3-morpholinopropyl)benzo[d]thiazol-2-amine
CAS Number:
1105188-72-4
Molecular Formula:
C14H17F2N3OS
Molecular Weight:
313.3661
MDL Number:
MFCD11987011
IUPAC Name:
4,6-difluoro-N-(3-morpholin-4-ylpropyl)-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C14H17F2N3OS/c15-10-8-11(16)13-12(9-10)21-14(18-13)17-2-1-3-19-4-6-20-7-5-19/h8-9H,1-7H2,(H,17,18)
InChI Key:
QKKGABKMQCSCAP-UHFFFAOYSA-N
SMILES:
Fc1cc(F)c2c(c1)sc(n2)NCCCN1CCOCC1
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.106g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
313.367g/mol
Monoisotopic Mass:
313.106g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
65.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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