| CAS Number | 1153133-35-7 |
| Catalog Number | AG01A9TG(AGN-PC-0WO8O8) |
| Chemical Name | 3-(3-Methoxyphenyl)-1,2,4-thiadiazol-5-amine |
| IUPAC Name | 3-(3-methoxyphenyl)-1,2,4-thiadiazol-5-amine |
| InChI | InChI=1S/C9H9N3OS/c1-13-7-4-2-3-6(5-7)8-11-9(10)14-12-8/h2-5H,1H3,(H2,10,11,12) |
| InChI Key | OQPXWQMYTDLODL-UHFFFAOYSA-N |
| MDL Number | MFCD12137231 |
| Molecular Formula | C9H9N3OS |
| Molecular Weight | 207.2523 |
| SMILES | COC1=CC(C2N=C(N)SN=2)=CC=C1 |
| Synonyms | 3-(3-methoxyphenyl)-1,2,4-thiadiazol-5-amine,
1153133-35-7,
NS-02261,
ST45243656,
EN300-66081,
Z1262398441,
3-(3-methoxyphenyl)-1,2,4-thiadiazole-5-ylamine,
AC1Q47Z0,
SBB073173,
STL219908,
ZINC36753199,
AKOS005142962,
MCULE-6703188005,
NE32372,
|
| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.251g/mol |
| Monoisotopic Mass | 207.047g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 89.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number