Lometrexol

CAT: 0931-T15826-07Size: 100 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0931-T15826-07Size:100 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

106400-81-1

Target

Antifolate, Apoptosis, Bcl-2 Family, Caspase, DHFR

Related Pathways

Metabolism, Cell Cycle/Checkpoint, DNA Damage/DNA Repair, Apoptosis, Proteases/Proteasome

Purity

0.9956

Bioactivity

Lometrexol (LY 264618), an antipurine Antifolate, can inhibit the activity of glycinamide ribonucleotide formyltransferase (GARFT) but do not induce detectable levels of DNA strand breaks. Lometrexol can further inhibit de novo purine synthesis, causing abnormal cell proliferation and Apoptosis, even cell cycle arrest. Lometrexol has anticancer activity. Lometrexol also is a potent human Serine hydroxymethyltransferase1/2 (hSHMT1/2) inhibitor.

Smiles

Nc1nc2NC[C@H](CCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)Cc2c(=O)[nH]1

Molecular Formula

C21H25N5O6

Molecular Weight

443.45

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Lometrexol

Lometrexol has been used in trials studying the treatment of Lung Cancer, Drug/Agent Toxicity by Tissue/Organ, and Unspecified Adult Solid Tumor, Protocol Specific.

CAS Number	106400-81-1
PubChem CID	135413518
IUPAC Name	(2S)-2-[[4-[2-[(6R)-2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-6-yl]ethyl]benzoyl]amino]pentanedioic acid
Molecular Formula	C21H25N5O6
Molecular Weight	443.5
XLogP	0.3
Topological Polar Surface Area	183
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	9
Heavy Atom Count	32
Formal Charge	0
Complexity	831

SMILES

C1[C@H](CNC2=C1C(=O)NC(=N2)N)CCC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)O)C(=O)O

InChI

InChI=1S/C21H25N5O6/c22-21-25-17-14(19(30)26-21)9-12(10-23-17)2-1-11-3-5-13(6-4-11)18(29)24-15(20(31)32)7-8-16(27)28/h3-6,12,15H,1-2,7-10H2,(H,24,29)(H,27,28)(H,31,32)(H4,22,23,25,26,30)/t12-,15+/m1/s1

InChIKey

ZUQBAQVRAURMCL-DOMZBBRYSA-N

Chemical Structure

2D Structure

CAS: 106400-81-1

CID: 135413518

Formula: C21H25N5O6

MW: 443.5

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	443.5
XLogP3	0.3
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	9
Exact Mass	443.18048353
Monoisotopic Mass	443.18048353
Topological Polar Surface Area	183 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	831
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
E1766-1mg	Lometrexol
HY-14521A-01	Lometrexol (disodium)
MBS5805914	Lometrexol disodium
GTR19188487-01	Lometrexol hydrate
HY-14521B-01	Lometrexol (hydrate)
A15980-5	Lometrexol disodium 5mg
A15980-25	Lometrexol disodium 25mg
A15980-10	Lometrexol disodium 10mg
597221	Lometrexol free acid
A15980-50	Lometrexol disodium 50mg

Lometrexol

Chemical Information

Alternative Products

Popular Products