| CAS Number | 250290-76-7 |
| Catalog Number | AG00C1FC(AGN-PC-0O88TP) |
| Chemical Name | Boc-Gln-Gln-OH |
| IUPAC Name | (2S)-5-amino-2-[[(2S)-5-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoyl]amino]-5-oxopentanoic acid |
| InChI | InChI=1S/C15H26N4O7/c1-15(2,3)26-14(25)19-8(4-6-10(16)20)12(22)18-9(13(23)24)5-7-11(17)21/h8-9H,4-7H2,1-3H3,(H2,16,20)(H2,17,21)(H,18,22)(H,19,25)(H,23,24)/t8-,9-/m0/s1 |
| InChI Key | WQOCAMYLRIWQMA-IUCAKERBSA-N |
| MDL Number | MFCD11113785 |
| Molecular Formula | C15H26N4O7 |
| Molecular Weight | 374.3895 |
| SMILES | NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)NC(=O)OC(C)(C)C |
| Synonyms | BOC-GLN-GLN-OH,
250290-76-7,
SCHEMBL7536423,
C15H26N4O7,
6356AH,
MFCD11113785,
ZINC95495908,
K-6623,
|
| Complexity | 557 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 374.18g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 5 |
| Isotope Atom Count | 0 |
| Molecular Weight | 374.394g/mol |
| Monoisotopic Mass | 374.18g/mol |
| Rotatable Bond Count | 12 |
| Topological Polar Surface Area | 191A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number