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105951-33-5 | 5H-Thieno[3,2-b]thiopyran-2-sulfonamide, 6,7-dihydro-7-hydroxy-
CAS No: 105951-33-5 Catalog No: AG007EK4 MDL No:
Product Description
Catalog Number:
AG007EK4
Chemical Name:
5H-Thieno[3,2-b]thiopyran-2-sulfonamide, 6,7-dihydro-7-hydroxy-
CAS Number:
105951-33-5
Molecular Formula:
C7H9NO3S3
Molecular Weight:
251.3463
IUPAC Name:
7-hydroxy-6,7-dihydro-5H-thieno[3,2-b]thiopyran-2-sulfonamide
InChI:
InChI=1S/C7H9NO3S3/c8-14(10,11)6-3-5-7(13-6)4(9)1-2-12-5/h3-4,9H,1-2H2,(H2,8,10,11)
InChI Key:
UGQVTTBSGZLNIL-UHFFFAOYSA-N
SMILES:
OC1CCSc2c1sc(c2)S(=O)(=O)N
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.974g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
251.333g/mol
Monoisotopic Mass:
250.974g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
142A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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