Cas no 188829-39-2 (4-(4-Hydroxyanilino)-6,7-dimethoxyquinazoline hydrochloride)
188829-39-2 structure
Product Name:4-(4-Hydroxyanilino)-6,7-dimethoxyquinazoline hydrochloride
CAS No:188829-39-2
MF:C16H16ClN3O3
MW:333.769542694092
CID:115428
PubChem ID:22022153
Update Time:2024-10-31
4-(4-Hydroxyanilino)-6,7-dimethoxyquinazoline hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- Phenol,4-[(6,7-dimethoxy-4-quinazolinyl)amino]-, hydrochloride (1:1)
- 4-(4-hydroxyanilino)-6,7-dimethoxyquinazoline hydrochloride
- 4-(4'-hydroxylphenyl)-amino-6,7-dimethoxyquinazoline hydrochloride dihydrate
- JANEX-1, 4-(4μ-Hydroxylphenyl)-amino-6,7-dimethoxyquinazoline hydrate hydrochloride
- WHI-P131 hydrate hydrochloride
- WHI-P131 hydrochloride hydrate
- whi-p131hydrochloride dihydrate
- 4-(4′-Hydroxylphenyl)-amino-6,7-dimethoxyquinazoline hydrochloride hydrate
- WHI-P131 hydrate hydrochloride
- JANEX-1, 4-(4μ-Hydroxylphenyl)-amino-6,7-dimethoxyquinazoline hydrate hydrochloride
- JANEX-1 (hydrochloride)
- CHEMBL555201
- DB-305054
- CS-0146173
- 4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenol;hydrochloride
- HY-138222
- SCHEMBL6068752
- HNJNNCPPISFBGR-UHFFFAOYSA-N
- 188829-39-2
- 4-(4-Hydroxyanilino)-6,7-dimethoxyquinazoline hydrochloride
-
- Inchi： 1S/C16H15N3O3.ClH/c1-21-14-7-12-13(8-15(14)22-2)17-9-18-16(12)19-10-3-5-11(20)6-4-10;/h3-9,20H,1-2H3,(H,17,18,19);1H
- InChI Key： HNJNNCPPISFBGR-UHFFFAOYSA-N
- SMILES： Cl.O(C)C1C(=CC2C(C=1)=C(N=CN=2)NC1C=CC(=CC=1)O)OC
Computed Properties
- Exact Mass: 333.0880191g/mol
- Monoisotopic Mass: 333.0880191g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 23
- Rotatable Bond Count: 4
- Complexity: 350
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 4.9
- Topological Polar Surface Area: 76.5
4-(4-Hydroxyanilino)-6,7-dimethoxyquinazoline hydrochloride Related Literature
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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