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Proto-1

CAS No.:
312951-85-2
Catalog Number:
AG00C6JQ
Molecular Formula:
C17H19ClN4O2S
Molecular Weight:
378.8764
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$640
- +
10mg
98%
1 week
United States
$890
- +
50mg
98%
1 week
United States
$2557
- +
100mg
98%
1 week
United States
$3557
- +
Product Description
Catalog Number:
AG00C6JQ
Chemical Name:
Proto-1
CAS Number:
312951-85-2
Molecular Formula:
C17H19ClN4O2S
Molecular Weight:
378.8764
MDL Number:
MFCD01923572
IUPAC Name:
2-[(4-chlorophenyl)carbamoylamino]-6-ethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide
InChI:
InChI=1S/C17H19ClN4O2S/c1-2-22-8-7-12-13(9-22)25-16(14(12)15(19)23)21-17(24)20-11-5-3-10(18)4-6-11/h3-6H,2,7-9H2,1H3,(H2,19,23)(H2,20,21,24)
InChI Key:
QBLKUVUKIZEWAL-UHFFFAOYSA-N
SMILES:
CCN1CCc2c(C1)sc(c2C(=O)N)NC(=O)Nc1ccc(cc1)Cl
Properties
Complexity:
501  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.092g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
378.875g/mol
Monoisotopic Mass:
378.092g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties