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1105189-05-6 | 7-Chloro-4-methoxy-N-(2-morpholinoethyl)benzo[d]thiazol-2-amine
CAS No: 1105189-05-6 Catalog No: AG01FMGX MDL No:MFCD11987020
Product Description
Catalog Number:
AG01FMGX
Chemical Name:
7-Chloro-4-methoxy-N-(2-morpholinoethyl)benzo[d]thiazol-2-amine
CAS Number:
1105189-05-6
Molecular Formula:
C14H18ClN3O2S
Molecular Weight:
327.8296
MDL Number:
MFCD11987020
IUPAC Name:
7-chloro-4-methoxy-N-(2-morpholin-4-ylethyl)-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C14H18ClN3O2S/c1-19-11-3-2-10(15)13-12(11)17-14(21-13)16-4-5-18-6-8-20-9-7-18/h2-3H,4-9H2,1H3,(H,16,17)
InChI Key:
QUBJEKOZRWDPEJ-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1nc(s2)NCCN1CCOCC1)Cl
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.081g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
327.827g/mol
Monoisotopic Mass:
327.081g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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