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1105188-34-8 | N1-(4,7-Dimethoxybenzo[d]thiazol-2-yl)-N2,N2-diethylethane-1,2-diamine
CAS No: 1105188-34-8 Catalog No: AG01FMZ6 MDL No:MFCD11986996
Product Description
Catalog Number:
AG01FMZ6
Chemical Name:
N1-(4,7-Dimethoxybenzo[d]thiazol-2-yl)-N2,N2-diethylethane-1,2-diamine
CAS Number:
1105188-34-8
Molecular Formula:
C15H23N3O2S
Molecular Weight:
309.4270
MDL Number:
MFCD11986996
IUPAC Name:
N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N',N'-diethylethane-1,2-diamine
InChI:
InChI=1S/C15H23N3O2S/c1-5-18(6-2)10-9-16-15-17-13-11(19-3)7-8-12(20-4)14(13)21-15/h7-8H,5-6,9-10H2,1-4H3,(H,16,17)
InChI Key:
LMOLAOHCAVZAIM-UHFFFAOYSA-N
SMILES:
CCN(CCNc1sc2c(n1)c(OC)ccc2OC)CC
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.151g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
309.428g/mol
Monoisotopic Mass:
309.151g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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