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1448034-00-1 | 2-(2-(2-Morpholinothiazol-4-yl)ethyl)isoindoline-1,3-dione hydrochloride
CAS No: 1448034-00-1 Catalog No: AG01AS1Y MDL No:MFCD26954587
Product Description
Catalog Number:
AG01AS1Y
Chemical Name:
2-(2-(2-Morpholinothiazol-4-yl)ethyl)isoindoline-1,3-dione hydrochloride
CAS Number:
1448034-00-1
Molecular Formula:
C17H18ClN3O3S
Molecular Weight:
379.8611
MDL Number:
MFCD26954587
IUPAC Name:
2-[2-(2-morpholin-4-yl-1,3-thiazol-4-yl)ethyl]isoindole-1,3-dione;hydrochloride
InChI:
InChI=1S/C17H17N3O3S.ClH/c21-15-13-3-1-2-4-14(13)16(22)20(15)6-5-12-11-24-17(18-12)19-7-9-23-10-8-19;/h1-4,11H,5-10H2;1H
InChI Key:
PMJQETKOKLBWKA-UHFFFAOYSA-N
SMILES:
O=C1N(CCc2csc(n2)N2CCOCC2)C(=O)c2c1cccc2.Cl
Properties
Complexity:
474
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.076g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
379.859g/mol
Monoisotopic Mass:
379.076g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
91A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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