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CZ415

CAS No.:
1429639-50-8
Catalog Number:
AG009VTT
Molecular Formula:
C22H29N5O4S
Molecular Weight:
459.5618
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
98%
1 week
United States
$173
- +
5mg
98%
1 week
United States
$257
- +
10mg
98%
1 week
United States
$373
- +
50mg
98%
1 week
United States
$1290
- +
100mg
98%
1 week
United States
$2057
- +
Product Description
Catalog Number:
AG009VTT
Chemical Name:
CZ415
CAS Number:
1429639-50-8
Molecular Formula:
C22H29N5O4S
Molecular Weight:
459.5618
MDL Number:
MFCD30533321
IUPAC Name:
1-[4-[7,7-dimethyl-4-[(3S)-3-methylmorpholin-4-yl]-6,6-dioxo-5H-thieno[3,4-d]pyrimidin-2-yl]phenyl]-3-ethylurea
InChI:
InChI=1S/C22H29N5O4S/c1-5-23-21(28)24-16-8-6-15(7-9-16)19-25-18-17(13-32(29,30)22(18,3)4)20(26-19)27-10-11-31-12-14(27)2/h6-9,14H,5,10-13H2,1-4H3,(H2,23,24,28)/t14-/m0/s1
InChI Key:
IZLPVLBNRGPOHA-AWEZNQCLSA-N
SMILES:
CCNC(=O)Nc1ccc(cc1)c1nc(N2CCOC[C@@H]2C)c2c(n1)C(C)(C)S(=O)(=O)C2
Properties
Complexity:
778  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
459.194g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
459.565g/mol
Monoisotopic Mass:
459.194g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Literature
Title Journal
Starvation survival of Salmonella enteritidis. Journal of bacteriology 19760101
Properties