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Home Other Building Blocks 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine

10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine

CAS No.:
3159-07-7
Catalog Number:
AG0032NR
Molecular Formula:
C13H9NOS
Molecular Weight:
227.2817
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$14
- +
25g
98%
In Stock USA
United States
$54
- +
100g
98%
In Stock USA
United States
$150
- +
Product Description
Catalog Number:
AG0032NR
Chemical Name:
10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine
CAS Number:
3159-07-7
Molecular Formula:
C13H9NOS
Molecular Weight:
227.2817
MDL Number:
MFCD00901197
IUPAC Name:
5H-benzo[b][1,4]benzothiazepin-6-one
InChI:
InChI=1S/C13H9NOS/c15-13-9-5-1-3-7-11(9)16-12-8-4-2-6-10(12)14-13/h1-8H,(H,14,15)
InChI Key:
RTERDTBXBYNZIS-UHFFFAOYSA-N
SMILES:
O=C1Nc2ccccc2Sc2c1cccc2
NSC Number:
653252
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.04g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.281g/mol
Monoisotopic Mass:
227.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
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
Properties