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1333960-75-0 | 4-(Methylthio)-N-(2-morpholinoethyl)benzo[d]thiazol-2-amine
CAS No: 1333960-75-0 Catalog No: AG01FMH5 MDL No:MFCD21091909
Product Description
Catalog Number:
AG01FMH5
Chemical Name:
4-(Methylthio)-N-(2-morpholinoethyl)benzo[d]thiazol-2-amine
CAS Number:
1333960-75-0
Molecular Formula:
C14H19N3OS2
Molecular Weight:
309.4502
MDL Number:
MFCD21091909
IUPAC Name:
4-methylsulfanyl-N-(2-morpholin-4-ylethyl)-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C14H19N3OS2/c1-19-11-3-2-4-12-13(11)16-14(20-12)15-5-6-17-7-9-18-10-8-17/h2-4H,5-10H2,1H3,(H,15,16)
InChI Key:
DJYHCFPQLRQLBR-UHFFFAOYSA-N
SMILES:
CSc1cccc2c1nc(s2)NCCN1CCOCC1
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.097g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
309.446g/mol
Monoisotopic Mass:
309.097g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
90.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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