| CAS Number | 2002381-25-9 |
| Catalog Number | AG00BF76(AGN-PC-0WNHDP) |
| Chemical Name | 6,7-Dimethoxy-N-(2-methyl-4-phenoxyphenyl)quinazolin-4-amine |
| IUPAC Name | 6,7-dimethoxy-N-(2-methyl-4-phenoxyphenyl)quinazolin-4-amine |
| InChI | InChI=1S/C23H21N3O3/c1-15-11-17(29-16-7-5-4-6-8-16)9-10-19(15)26-23-18-12-21(27-2)22(28-3)13-20(18)24-14-25-23/h4-14H,1-3H3,(H,24,25,26) |
| InChI Key | PEKZLFZZBGBOPJ-UHFFFAOYSA-N |
| MDL Number | MFCD30489745 |
| Molecular Formula | C23H21N3O3 |
| Molecular Weight | 387.4311 |
| SMILES | COC=1C=C2C(=NC=NC2=CC1OC)NC1=C(C=C(C=C1)OC1=CC=CC=C1)C |
| Synonyms | APS-2-79,
APS-2-79,
2002381-25-9,
6,7-Dimethoxy-~{n}-(2-Methyl-4-Phenoxy-Phenyl)quinazolin-4-Amine,
SCHEMBL18153627,
6,7-dimethoxy-N-(2-methyl-4-phenoxyphenyl)quinazolin-4-amine,
BCP24938,
AKOS032945002,
ZINC575624003,
CS-5869,
HY-100627,
6U7,
A16231,
C000615616,
2002381-31-7,
|
| Complexity | 502 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 387.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 387.439g/mol |
| Monoisotopic Mass | 387.158g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 65.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number