| CAS Number | 1919820-28-2 |
| Catalog Number | AG01EO53(AGN-PC-3H4674) |
| Chemical Name | LTI-291 |
| IUPAC Name | 5,7-dimethyl-N-(4-pentoxycyclohexyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| InChI | InChI=1S/C20H30N4O2/c1-4-5-6-11-26-17-9-7-16(8-10-17)23-20(25)18-13-21-24-15(3)12-14(2)22-19(18)24/h12-13,16-17H,4-11H2,1-3H3,(H,23,25) |
| InChI Key | HZILSILAELSWKN-UHFFFAOYSA-N |
| MDL Number | MFCD31618016 |
| Molecular Formula | C20H30N4O2 |
| Molecular Weight | 358.4778 |
| SMILES | C(N[C@@H]1CC[C@@H](OCCCCC)CC1)(=O)C2=C3N(N=C2)C(C)=CC(C)=N3 |
| Synonyms | LTI-291,
1919820-28-2,
SCHEMBL17739965,
SCHEMBL19024862,
BCP25413,
EX-A2518,
HY-104038,
AK00779570,
CS-0026754,
5,7-dimethyl-N-((1r,4r)-4-(pentyloxy)cyclohexyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide,
|
| Complexity | 453 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 358.237g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 358.486g/mol |
| Monoisotopic Mass | 358.237g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 68.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number