Home Other Building Blocks 1H,2H,3H,4H,5H-thieno[3,2-e][1,4]diazepin-5-one

1H,2H,3H,4H,5H-thieno[3,2-e][1,4]diazepin-5-one

CAS No.:
304021-16-7
Catalog Number:
AG01ABFU
Molecular Formula:
C7H8N2OS
Molecular Weight:
168.2162
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01ABFU
Chemical Name:
1H,2H,3H,4H,5H-thieno[3,2-e][1,4]diazepin-5-one
CAS Number:
304021-16-7
Molecular Formula:
C7H8N2OS
Molecular Weight:
168.2162
MDL Number:
MFCD17977149
IUPAC Name:
1,2,3,4-tetrahydrothieno[3,2-e][1,4]diazepin-5-one
InChI:
InChI=1S/C7H8N2OS/c10-7-6-5(1-4-11-6)8-2-3-9-7/h1,4,8H,2-3H2,(H,9,10)
InChI Key:
DBHYNUPWRUCSDP-UHFFFAOYSA-N
SMILES:
O=C1NCCNc2c1scc2
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.036g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
168.214g/mol
Monoisotopic Mass:
168.036g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties