| CAS Number | 1610377-00-8 |
| Catalog Number | AG00J0NA(AGN-PC-0WAYEV) |
| Chemical Name | 1-(7,8,9,10-tetrahydropyrazino[1,2-b]indazol-1-yl)piperidine-3-carboxylic acid |
| IUPAC Name | 1-(7,8,9,10-tetrahydropyrazino[1,2-b]indazol-1-yl)piperidine-3-carboxylic acid |
| InChI | InChI=1S/C16H20N4O2/c21-16(22)11-4-3-8-19(10-11)15-14-12-5-1-2-6-13(12)18-20(14)9-7-17-15/h7,9,11H,1-6,8,10H2,(H,21,22) |
| InChI Key | SEGWDKUGXPSWJM-UHFFFAOYSA-N |
| MDL Number | MFCD28023511 |
| Molecular Formula | C16H20N4O2 |
| Molecular Weight | 300.3556 |
| SMILES | O=C(O)C4(CN(C1(=NC=CN3(C1=C2(C(CCCC2)=N3))))CCC4) |
| Synonyms | 1610377-00-8,
1-(7,8,9,10-tetrahydropyrazino[1,2-b]indazol-1-yl)piperidine-3-carboxylic acid,
1-{7H,8H,9H,10H-pyrazino[1,2-b]indazol-1-yl}piperidine-3-carboxylic acid,
HTS001281,
MFCD28023511,
AKOS025392424,
BS-3106,
KS-0000235L,
OR310702,
C16H20N4O2,
|
| Complexity | 432 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 300.159g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 300.362g/mol |
| Monoisotopic Mass | 300.159g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 70.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number