N-[(4-Fluorophenyl)methyl]prop-2-enamide - CAS 1046471-60-6
Catalog: |
BB056115 |
Product Name: |
N-[(4-Fluorophenyl)methyl]prop-2-enamide |
CAS: |
1046471-60-6 |
Synonyms: |
N-[(4-fluorophenyl)methyl]prop-2-enamide |
IUPAC Name: | N-[(4-fluorophenyl)methyl]prop-2-enamide |
Description: | N-[(4-Fluorophenyl)methyl]prop-2-enamide is a mTORC1 inhibitor for activating autophagy. |
Molecular Weight: | 179.19 |
Molecular Formula: | C10H10NOF |
Canonical SMILES: | C=CC(=O)NCC1=CC=C(C=C1)F |
InChI: | InChI=1S/C10H10FNO/c1-2-10(13)12-7-8-3-5-9(11)6-4-8/h2-6H,1,7H2,(H,12,13) |
InChI Key: | JUDUJOWHIMYLRZ-UHFFFAOYSA-N |
Melting Point: | 116-119°C |
Solubility: | Chloroform (Slightly), DMSO (Slightly) |
Appearance: | White to Off-White Solid |
Storage: | -20°C, Light sensitive |
References: | Nomura, D. K., et al. PCT Int. Appl. (2020), WO 2020146779 A1. |
Complexity: | 185 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 179.074642105 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 179.074642105 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 29.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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