5-Benzyl-4,5,6,7-tetrahydro-5-azaindole - CAS 272442-27-0
Catalog: |
BB019501 |
Product Name: |
5-Benzyl-4,5,6,7-tetrahydro-5-azaindole |
CAS: |
272442-27-0 |
Synonyms: |
5-(phenylmethyl)-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine; 5-benzyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine |
IUPAC Name: | 5-benzyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine |
Description: | 5-Benzyl-4,5,6,7-tetrahydro-5-azaindole (CAS# 272442-27-0) is a useful research chemical. |
Molecular Weight: | 212.29 |
Molecular Formula: | C14H16N2 |
Canonical SMILES: | C1CN(CC2=C1NC=C2)CC3=CC=CC=C3 |
InChI: | InChI=1S/C14H16N2/c1-2-4-12(5-3-1)10-16-9-7-14-13(11-16)6-8-15-14/h1-6,8,15H,7,9-11H2 |
InChI Key: | RRLDTKNWNRBUBK-UHFFFAOYSA-N |
Boiling Point: | 364.6 °C at 760 mmHg |
Density: | 1.154 g/cm3 |
Appearance: | Solid |
LogP: | 2.51090 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3464286-A1 | Pyrazolopyridine derivatives for the treatment of cancer | 20160524 |
JP-2019516759-A | Pyrazolopyridine derivatives for the treatment of cancer | 20160524 |
US-2019241558-A1 | Therapeutic compounds and uses thereof | 20160524 |
WO-2017205538-A1 | Pyrazolopyridine derivatives for the treatment of cancer | 20160524 |
EP-3464286-B1 | Pyrazolopyridine derivatives for the treatment of cancer | 20160524 |
Complexity: | 223 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 212.131348519 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 212.131348519 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 19 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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