4TS
5-(3-chlorophenyl)-6-[2-(3-phenoxypropoxy)ethyl]pyrimidine-2,4-diamine
Find entries where: 4TS
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | 5-(3-chlorophenyl)-6-[2-(3-phenoxypropoxy)ethyl]pyrimidine-2,4-diamine |
Identifiers | 5-(3-chlorophenyl)-6-[2-(3-phenoxypropoxy)ethyl]pyrimidine-2,4-diamine |
Formula | C21 H23 Cl N4 O2 |
Molecular Weight | 398.886 |
Type | NON-POLYMER |
Isomeric SMILES | c1ccc(cc1)OCCCOCCc2c(c(nc(n2)N)N)c3cccc(c3)Cl |
InChI | InChI=1S/C21H23ClN4O2/c22-16-7-4-6-15(14-16)19-18(25-21(24)26-20(19)23)10-13-27-11-5-12-28-17-8-2-1-3-9-17/h1-4,6-9,14H,5,10-13H2,(H4,23,24,25,26) |
InChIKey | CRGQDUYGPMHVEY-UHFFFAOYSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 51 |
Chiral Atom Count | 0 |
Bond Count | 53 |
Aromatic Bond Count | 18 |
Related Resource References
Resource Name | Reference |
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PubChem | 10927461 |
ChEMBL | CHEMBL22403 |