Products for Research Use Only
RegisterLogin

ML395

CAT: 0013-GTR19197036-03Size: 100 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19197036-03Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
ML395 is a potent and selective allosteric inhibitor of phospholipase D2 (PLD2), demonstrating antiviral activity with an IC50 of 360 nM. This small molecule is a valuable research tool for investigating PLD2's role in virology and related signaling pathways in both cellular and biochemical assays.
CAS Number
1638957-17-1
Field of Research
Metabolism Research
Smiles
C (N1C2 (CCN (CCNC (=O) C3=CC4=C (C=C3) C=CC=C4) CC2) C (=O) NC1) C=5C=CC=NC5
Molecular Formula
C26H29N5O2
Molecular Weight
443.54
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-[2-[4-oxo-1-(pyridin-3-ylmethyl)-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]naphthalene-2-carboxamide
CAS Number1638957-17-1
PubChem CID73099418
IUPAC NameN-[2-[4-oxo-1-(pyridin-3-ylmethyl)-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]naphthalene-2-carboxamide
Molecular FormulaC26H29N5O2
Molecular Weight443.5
XLogP2.5
Topological Polar Surface Area77.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count33
Formal Charge0
Complexity692
SMILES
C1CN(CCC12C(=O)NCN2CC3=CN=CC=C3)CCNC(=O)C4=CC5=CC=CC=C5C=C4
InChI
InChI=1S/C26H29N5O2/c32-24(23-8-7-21-5-1-2-6-22(21)16-23)28-12-15-30-13-9-26(10-14-30)25(33)29-19-31(26)18-20-4-3-11-27-17-20/h1-8,11,16-17H,9-10,12-15,18-19H2,(H,28,32)(H,29,33)
InChIKey
VBJYNYMKFQGJCH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[2-[4-oxo-1-(pyridin-3-ylmethyl)-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]naphthalene-2-carboxamide
CAS: 1638957-17-1
CID: 73099418
Formula: C26H29N5O2
MW: 443.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight443.5
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass443.23212518
Monoisotopic Mass443.23212518
Topological Polar Surface Area77.6 Ų
Heavy Atom Count33
Formal Charge0
Complexity692
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

Related Products

CatalogName
GTR19197039-01ML375
GTR19170297-01ML355
GTR19169025-01ML335
GTR19156996-01ML390
GTR19160487-01ML355
GTR19159238-01ML365
GTR19199929-01ML399
GTR19170328-01ML365
GTR19175769-01ML390
GTR19170286-01ML385

Alternative Products

CatalogName
MBS5777768ML395

Popular Products