AC1L830J
benzyl 4-[(ethoxycarbonylamino)sulfamoyl]-2-(phenylmethoxycarbonylamino)butanoate
Also Known As: AG-G-68872|benzyl 4-[(ethoxycarbonylamino)sulfamoyl]-2-(phenylmethoxyca|benzyl 4-[(ethoxycarbonylamino)sulfamoyl]-2-(phenylmethoxycarbonylamino)butanoate|10-Oxa-6-thia-2,7,8-triazadodecanoicacid, 9-oxo-3-[(phenylmethoxy)carbonyl]-, phenylmethyl ester, 6,6-dioxide|Ethyl 7-[(benzyloxy)carbonyl]-4,4,9-trioxo-11-phenyl-10-oxa-4lambda~6~-thia-2,3,8-triazaundecan-1-oate
| Molecular Formula | C22H27N3O8S |
|---|---|
| Molecular Weight | 493.1519 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 15 |
| Exact Mass | 493.1519 |
| Monoisotopic Mass | 493.1519 |
| Heavy Atoms | 34 |
| Complexity | 744.0 |
Chemical Identifiers
| CAS Number | 69164-75-6 |
|---|---|
| SMILES | CCOC(=O)NNS(=O)(=O)CCC(C(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2 |
| InChIKey | PKVRHXSCRNUYJB-UHFFFAOYSA-N |
Product Overview
AC1L830J (CAS 69164-75-6), with molecular formula C22H27N3O8S and molecular weight 493.1519 g/mol. IUPAC: benzyl 4-[(ethoxycarbonylamino)sulfamoyl]-2-(phenylmethoxycarbonylamino)butanoate.
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