3-methylazepane hydrochloride - CAS 1798010-22-6
Catalog: |
BB013599 |
Product Name: |
3-methylazepane hydrochloride |
CAS: |
1798010-22-6 |
Synonyms: |
3-methylazepane;hydrochloride; 3-methylazepane;hydrochloride |
IUPAC Name: | 3-methylazepane;hydrochloride |
Description: | 3-methylazepane hydrochloride (CAS# 1798010-22-6) is a useful research chemical. |
Molecular Weight: | 149.662 |
Molecular Formula: | C7H16ClN |
Canonical SMILES: | CC1CCCCNC1.Cl |
InChI: | InChI=1S/C7H15N.ClH/c1-7-4-2-3-5-8-6-7;/h7-8H,2-6H2,1H3;1H |
InChI Key: | WDIJVCDMRLXFMB-UHFFFAOYSA-N |
LogP: | 2.52680 |
Publication Number | Title | Priority Date |
WO-2021089683-A1 | Inhibitors of adrenoreceptor adrac2 | 20191106 |
WO-2020236654-A1 | Cyano cyclobutyl compounds for cbl-b inhibition and uses thereof | 20190517 |
US-2021053986-A1 | Cyano cyclobutyl compounds for cbl-b inhibition and uses thereof | 20190517 |
Complexity: | 61.4 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 149.0971272 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 149.0971272 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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