Basic information
- CAS
83158-06-9- Standard SMILES
COc1cc(Cc2cnc(N)nc2N)ccc1OCc1ccccc1- InChIKey
KRZXDTYOZAQOGL-UHFFFAOYSA-N- Molecular formula
- C19H20N4O2
- Average molar mass
- 336.4 g/mol
- Monoisotopic mass
- 336.15862589
Names & identifiers
- Preferred name
- 2,4-Pyrimidinediamine, 5-((3-methoxy-4-(phenylmethoxy)phenyl)methyl)-
- IUPAC
- 5-[(3-methoxy-4-phenylmethoxyphenyl)methyl]pyrimidine-2,4-diamine
- English name
- 5-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]pyrimidine-2,4-diamine
- Molecular formula
- C19H20N4O2
- Molecular weight
- 0
Names & synonyms
83158-06-92,4-Pyrimidinediamine, 5-((3-methoxy-4-(phenylmethoxy)phenyl)methyl)-2,4-Diamino-5-(3-methoxy-4-benzyloxybenzyl)pyrimidineDTXSID702321945-((3-Methoxy-4-(phenylmethoxy)phenyl)methyl)-2,4-pyrimidinediamineRefChem:246911DTXCID701546855-(4-(benzyloxy)-3-methoxybenzyl)pyrimidine-2,4-diamineCHEMBL22146SCHEMBL8377009BDBM501107765-{[4-(BENZYLOXY)-3-METHOXYPHENYL]METHYL}PYRIMIDINE-2,4-DIAMINE
Show more names
GH-1012,4-Diamino-5-[4-benzyloxy-3-methoxybenzyl]pyrimidine5-[4-(Benzyloxy)-3-methoxybenzyl]pyrimidine-2,4-diamine5-[[3-Methoxy-4-(benzyloxy)phenyl]methyl]-2,4-pyrimidinediamine5-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]pyrimidine-2,4-diamine
5-(4-Benzyloxy-3-methoxy-benzyl)-pyrimidine-2,4-diamine5-[(4-benzyloxy-3-methoxy-phenyl)methyl]pyrimidine-2,4-diamine5-{[3-Methoxy-4-(phenylmethoxy)phenyl]methyl}pyrimidine-2,4-diamine
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 96.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 392
Experimental & physicochemical properties
LogP2.66
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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