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102582-79-6 | 2(1H)-Quinoxalinone, 6-chloro-1-[3-(dimethylamino)propyl]-3-methyl-
CAS No: 102582-79-6 Catalog No: AG0007TY MDL No:
Product Description
Catalog Number:
AG0007TY
Chemical Name:
2(1H)-Quinoxalinone, 6-chloro-1-[3-(dimethylamino)propyl]-3-methyl-
CAS Number:
102582-79-6
Molecular Formula:
C14H18ClN3O
Molecular Weight:
279.7652
IUPAC Name:
6-chloro-1-[1-(dimethylamino)propyl]-3-methylquinoxalin-2-one
InChI:
InChI=1S/C14H18ClN3O/c1-5-13(17(3)4)18-12-7-6-10(15)8-11(12)16-9(2)14(18)19/h6-8,13H,5H2,1-4H3
InChI Key:
UYCDXNTWWHFKFY-UHFFFAOYSA-N
SMILES:
CN(CCCn1c(=O)c(C)nc2c1ccc(c2)Cl)C
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.114g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.768g/mol
Monoisotopic Mass:
279.114g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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