4-Chloro-8-methoxyquinazoline - CAS 154288-09-2
Catalog: |
BB010998 |
Product Name: |
4-Chloro-8-methoxyquinazoline |
CAS: |
154288-09-2 |
Synonyms: |
4-chloro-8-methoxyquinazoline; 4-chloro-8-methoxyquinazoline |
IUPAC Name: | 4-chloro-8-methoxyquinazoline |
Description: | 4-Chloro-8-methoxyquinazoline (CAS# 154288-09-2) is used in preparation of of Quinazoline derivatives as Ectonucleotide Pyrophosphatase Phosphodiesterase 1 inhibitors. |
Molecular Weight: | 194.62 |
Molecular Formula: | C9H7ClN2O |
Canonical SMILES: | COC1=CC=CC2=C1N=CN=C2Cl |
InChI: | InChI=1S/C9H7ClN2O/c1-13-7-4-2-3-6-8(7)11-5-12-9(6)10/h2-5H,1H3 |
InChI Key: | BIGSOYZPKXOBJZ-UHFFFAOYSA-N |
Boiling Point: | 322.973 °C at 760 mmHg |
Density: | 1.333 g/cm3 |
LogP: | 2.29180 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021116260-A1 | Quinazoline derivatives as lpa receptor 2 inhibitors | 20191212 |
US-2020352942-A1 | Dosage forms and regimens for amino acid compounds | 20190408 |
WO-2020210404-A1 | Dosage forms and regimens for amino acid compounds | 20190408 |
WO-2020140001-A1 | Quinazoline derivatives as ectonucleotide pyrophosphatase phosphodiesterase 1 inhibitors | 20181228 |
EP-3632908-A1 | Inhibitors of the yap/taz-tead interaction and their use in the treatment of cancer | 20181002 |
Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 194.0246905 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 194.0246905 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 35 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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