| CAS Number | 852916-56-4 |
| Catalog Number | AG00G3TL |
| Chemical Name | N-(3-(4-(2-Aminothiazol-4-yl)phenyl)propyl)acetamide |
| IUPAC Name | N-[3-[4-(2-amino-1,3-thiazol-4-yl)phenyl]propyl]acetamide |
| InChI | InChI=1S/C14H17N3OS/c1-10(18)16-8-2-3-11-4-6-12(7-5-11)13-9-19-14(15)17-13/h4-7,9H,2-3,8H2,1H3,(H2,15,17)(H,16,18) |
| InChI Key | YOUJDBHDDBOOEG-UHFFFAOYSA-N |
| MDL Number | MFCD06655661 |
| Molecular Formula | C14H17N3OS |
| Molecular Weight | 275.3693 |
| SMILES | CC(NCCCC1=CC=C(C2=CSC(N)=N2)C=C1)=O |
| Synonyms | N-{3-[4-(2-amino-1,3-thiazol-4-yl)phenyl]propyl}acetamide,
852916-56-4,
N-[3-[4-(2-amino-1,3-thiazol-4-yl)phenyl]propyl]acetamide,
AC1NLQBH,
AC1Q1L6G,
CTK6A1201,
HMS1771J19,
ZINC3888777,
AKOS027427167,
MCULE-2204307691,
NE31600,
EN300-13103,
SR-01000068699,
J-523357,
SR-01000068699-1,
Z89239704,
N-(3-(4-(2-Aminothiazol-4-yl)phenyl)propyl)acetamide,
ZINC03888777,
CID4962231,
|
| Complexity | 292 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 275.109g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 275.37g/mol |
| Monoisotopic Mass | 275.109g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 96.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number