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KIF18A-IN-6

CAT: 0607-BA4235-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-BA4235-10Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2914879-10-8
Form
A solid
Molecular Formula
C28H37N3O5S2
Molecular Weight
559.74
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Kif18A-IN-6
CAS Number2914879-10-8
PubChem CID167493856
Molecular FormulaC28H37N3O5S2
Molecular Weight559.7
XLogP4.6
Topological Polar Surface Area129
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count38
Formal Charge0
Complexity1100
SMILES
CCS(=O)(=O)NC1=CC2=C(C=C1)N(CC23CCC4(CC4)CC3)C(=O)C5=CC(=CC=C5)S(=O)(=O)NC(C)(C)C
InChI
InChI=1S/C28H37N3O5S2/c1-5-37(33,34)29-21-9-10-24-23(18-21)28(15-13-27(11-12-27)14-16-28)19-31(24)25(32)20-7-6-8-22(17-20)38(35,36)30-26(2,3)4/h6-10,17-18,29-30H,5,11-16,19H2,1-4H3
InChIKey
AXRRVVWONHGXHG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Kif18A-IN-6
CAS: 2914879-10-8
CID: 167493856
Formula: C28H37N3O5S2
MW: 559.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight559.7
XLogP34.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass559.21746364
Monoisotopic Mass559.21746364
Topological Polar Surface Area129 Ų
Heavy Atom Count38
Formal Charge0
Complexity1100
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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