5-Deazamethotrexate

Modify Date: 2026-08-15 09:44:20

5-Deazamethotrexate Structure
5-Deazamethotrexate structure
Common Name 5-Deazamethotrexate
CAS Number 80360-10-7 Molecular Weight 453.45100
Density 1.499g/cm3 Boiling Point N/A
Molecular Formula C21H23N7O5 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-[[4-[(2,4-diaminopyrido[2,3-d]pyrimidin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.499g/cm3
Molecular Formula C21H23N7O5
Molecular Weight 453.45100
Exact Mass 453.17600
PSA 197.65000
LogP 2.42670
Index of Refraction 1.731
InChIKey DSXZZNYIRMPBTN-UHFFFAOYSA-N
SMILES CN(Cc1cnc2nc(N)nc(N)c2c1)c1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1

 5-DeazamethotrexateBioassay

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Name: Compound at a optimum dose level of 0.5 mg/kg was evaluated in vivo against Murine P3...
Source: ChEMBL
Target: P388
External Id: CHEMBL745048
Name: Compound at a optimum dose level of 2 mg/kg was evaluated in vivo against Murine P388...
Source: ChEMBL
Target: P388
External Id: CHEMBL745654
Name: Compound was evaluated for rate of anabolism to polyglutamate accumulation in L1210 c...
Source: ChEMBL
Target: L1210
External Id: CHEMBL706999
Name: Compound was evaluated for inhibitory effect on growth of L1210 cells at IC50 (n=4)
Source: ChEMBL
Target: L1210
External Id: CHEMBL706065
Name: Compound at a optimum dose level of 0.5 mg/kg was evaluated in vivo against Murine P3...
Source: ChEMBL
Target: P388
External Id: CHEMBL746682
Name: Compound at a optimum dose level of 0.5 mg/kg was evaluated in vivo against Murine P3...
Source: ChEMBL
Target: P388
External Id: CHEMBL745049
Name: Compound was evaluated for inhibitory effect on dihydrofolate reductase (DHFR) from L...
Source: ChEMBL
Target: Dihydrofolate reductase
External Id: CHEMBL667318
Name: Compound was evaluated for the efflux (K) mediated transport with respect to L1210 ce...
Source: ChEMBL
Target: L1210
External Id: CHEMBL703287
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 Synonyms

5-deazamethotrexate
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