Basic information
- CAS
273727-89-2- Standard SMILES
CC(C)N(CCC(=O)c1ccc2ccccc2c1)Cc1ccccc1- InChIKey
JSASWRWALCMOQP-UHFFFAOYSA-N- Molecular formula
- C23H25NO
- Average molar mass
- 331.4 g/mol
- Monoisotopic mass
- 331.19361442
Overview
1-(2-naphthalenyl)-3-[(phenylmethyl)-propan-2-ylamino]-1-propanone is a member of naphthalenes.
Names & identifiers
- Preferred name
- ZM-39923
- IUPAC
- 3-[benzyl(propan-2-yl)amino]-1-naphthalen-2-ylpropan-1-one
- English name
- 1-Propanone, 3-[(1-methylethyl)(phenylmethyl)amino]-1-(2-naphthalenyl)-
- Molecular formula
- C23H25NO
- Molecular weight
- 331.45
Names & synonyms
273727-89-2ZM-39923jak3 inhibitor iv3-[benzyl(propan-2-yl)amino]-1-(naphthalen-2-yl)propan-1-oneM0ZX82000S1-Propanone, 3-[(1-methylethyl)(phenylmethyl)amino]-1-(2-naphthalenyl)-3-(Benzyl(propan-2-yl)amino)-1-(naphthalen-2-yl)propan-1-one3-((1-Methylethyl)(phenylmethyl)amino)-1-(2-naphthalenyl)-1-propanone1-Propanone, 3-((1-methylethyl)(phenylmethyl)amino)-1-(2-naphthalenyl)-RefChem:1101198ZM399233-(benzyl(isopropyl)amino)-1-(naphthalen-2-yl)propan-1-one
Show more names
JSASWRWALCMOQP-UHFFFAOYSA-NNCGC00025126-01Tocris-13673-[benzyl(propan-2-yl)amino]-1-naphthalen-2-ylpropan-1-oneLopac-Z-4626Lopac0_000844UNII-M0ZX82000SCHEMBL596674
Database identifiers
- CAS
273727-89-2- PubChem CID
- 3797
- DTXSID
DTXSID701017205
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 412
Physicochemical properties
- Boiling point
- 478.8 · 478.8±28.0 °C(Predicted)
- Density
- 1.083 · 1.083±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- Soluble in DMSO
- pka
- 7.99 · 7.99±0.50(Predicted)
- FDA UNII
- 0 ZX82000S · M0ZX82000S
Chemistry & industry
Applications
UsesZM39923 is a JAK3 inhibitor, with a pIC50 of 7.1; ZM39923 also potently inhibits tissue transglutaminase (TGM2) with an IC50 of 10 nM.
Suppliers10 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
南通全益生物科技有限公司0513-66337626 18051384581 · [email protected]
上海芮晖化工科技有限公司021-31433387 15618786686 · [email protected]
常州美泰生物科技有限公司0519-83246372 13585352506
Musechem+1-800-259-7612 · [email protected]
范德(北京)生物科技有限责任公司15911056312 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海传芊化工科技中心15869524721 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
Additional notes
DefinitionChEBI: 1-(2-naphthalenyl)-3-[(phenylmethyl)-propan-2-ylamino]-1-propanone is a member of naphthalenes.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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