4-(4-Methyloxazol-5-yl)aniline - CAS 267648-20-4
Catalog: |
BB055223 |
Product Name: |
4-(4-Methyloxazol-5-yl)aniline |
CAS: |
267648-20-4 |
Synonyms: |
4-(4-methyl-1,3-oxazol-5-yl)aniline |
IUPAC Name: | 4-(4-methyl-1,3-oxazol-5-yl)aniline |
Molecular Weight: | 174.2 |
Molecular Formula: | C10H10N2O |
Canonical SMILES: | CC1=C(OC=N1)C2=CC=C(C=C2)N |
InChI: | InChI=1S/C10H10N2O/c1-7-10(13-6-12-7)8-2-4-9(11)5-3-8/h2-6H,11H2,1H3 |
InChI Key: | DSYHPMBYDBNIHN-UHFFFAOYSA-N |
References: | Bacon, E.M., et.al. U.S. Pat. Appl. Publ. US 20180230157 A1, 438, (2018). |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020127685-A1 | Amino-acid anilides as small molecule modulators of il-17 | 20181219 |
TW-201028381-A | Pyridine derivative having ttk inhibition activity | 20080714 |
WO-2010007756-A1 | Pyridine derivative having ttk inhibition activity | 20080714 |
AU-1131500-A | Compounds derived from an amine nucleus that are inhibitors of impdh enzyme | 19981029 |
EP-1126843-A1 | Compounds derived from an amine nucleus that are inhibitors of impdh enzyme | 19981029 |
EP-1126843-A4 | AMINO-CELL DERIVATIVE COMPOUNDS INHIBITORS OF ENZYME IMPDH | 19981029 |
JP-2002528499-A | Amino nucleus-derived compounds that are inhibitors of the IMPDH enzyme | 19981029 |
US-6399773-B1 | Compounds derived from an amine nucleus that are inhibitors of IMPDH enzyme | 19981029 |
WO-0025780-A1 | Compounds derived from an amine nucleus that are inhibitors of impdh enzyme | 19981029 |
Complexity: | 166 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 174.079312947 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 174.079312947 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 52Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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