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151391-67-2 | Carbamic acid, (10-(3-(4-morpholinyl)-1-oxopropyl)-5,5-dioxdo-10H-phen othiazin-2-yl)-, ethyl ester
CAS No: 151391-67-2 Catalog No: AG00AWKO MDL No:
Product Description
Catalog Number:
AG00AWKO
Chemical Name:
Carbamic acid, (10-(3-(4-morpholinyl)-1-oxopropyl)-5,5-dioxdo-10H-phen othiazin-2-yl)-, ethyl ester
CAS Number:
151391-67-2
IUPAC Name:
ethyl N-[10-(3-morpholin-4-ylpropanoyl)-5,5-dioxophenothiazin-2-yl]carbamate
InChI:
InChI=1S/C22H25N3O6S/c1-2-31-22(27)23-16-7-8-20-18(15-16)25(17-5-3-4-6-19(17)32(20,28)29)21(26)9-10-24-11-13-30-14-12-24/h3-8,15H,2,9-14H2,1H3,(H,23,27)
InChI Key:
JGBQVBXTCBGQLU-UHFFFAOYSA-N
Properties
Complexity:
779
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
459.146g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
459.517g/mol
Monoisotopic Mass:
459.146g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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