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606120-07-4 | Piperazine, 1-(2-benzothiazolyl)-4-[(2,3-dihydro-2,6-dimethyl-3-oxo-4H-1,4-benzoxazin-4-yl)acetyl]- (9CI)
CAS No: 606120-07-4 Catalog No: AG00EHVH MDL No:
Product Description
Catalog Number:
AG00EHVH
Chemical Name:
Piperazine, 1-(2-benzothiazolyl)-4-[(2,3-dihydro-2,6-dimethyl-3-oxo-4H-1,4-benzoxazin-4-yl)acetyl]- (9CI)
CAS Number:
606120-07-4
IUPAC Name:
4-[2-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxoethyl]-2,6-dimethyl-1,4-benzoxazin-3-one
InChI:
InChI=1S/C23H24N4O3S/c1-15-7-8-19-18(13-15)27(22(29)16(2)30-19)14-21(28)25-9-11-26(12-10-25)23-24-17-5-3-4-6-20(17)31-23/h3-8,13,16H,9-12,14H2,1-2H3
InChI Key:
ZXGIWXJDNFGTFM-UHFFFAOYSA-N
Properties
Complexity:
686
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
436.157g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
436.53g/mol
Monoisotopic Mass:
436.157g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
94.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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