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FHT-1204

CAT: 0607-BA4700-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-BA4700-10Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2468048-24-8
Form
A solid
Molecular Formula
C24H23N5O5S2
Molecular Weight
525.60
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

CID 154667935
CAS Number2468048-24-8
PubChem CID154667935
IUPAC NameN-[(2S)-3-methoxy-1-oxo-1-[[4-(3-pyridin-4-ylphenyl)-1,3-thiazol-2-yl]amino]propan-2-yl]-1-methylsulfonylpyrrole-3-carboxamide
Molecular FormulaC24H23N5O5S2
Molecular Weight525.6
XLogP2
Topological Polar Surface Area169
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Heavy Atom Count36
Formal Charge0
Complexity863
SMILES
COC[C@@H](C(=O)NC1=NC(=CS1)C2=CC=CC(=C2)C3=CC=NC=C3)NC(=O)C4=CN(C=C4)S(=O)(=O)C
InChI
InChI=1S/C24H23N5O5S2/c1-34-14-20(26-22(30)19-8-11-29(13-19)36(2,32)33)23(31)28-24-27-21(15-35-24)18-5-3-4-17(12-18)16-6-9-25-10-7-16/h3-13,15,20H,14H2,1-2H3,(H,26,30)(H,27,28,31)/t20-/m0/s1
InChIKey
AXMLAOCXALIIRY-FQEVSTJZSA-N
Chemical Structure
2D Structure
2D structure of CID 154667935
CAS: 2468048-24-8
CID: 154667935
Formula: C24H23N5O5S2
MW: 525.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight525.6
XLogP32
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Exact Mass525.11406120
Monoisotopic Mass525.11406120
Topological Polar Surface Area169 Ų
Heavy Atom Count36
Formal Charge0
Complexity863
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes