AC1L9NU7
ethyl 2-[[3-[[3-[(2-ethoxy-2-oxoethyl)amino]-3-oxo-2-(phenylmethoxycarbonylamino)propyl]disulfanyl]-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetate
Also Known As: ethyl 2-[[3-[[3-[(2-ethoxy-2-oxoethyl)amino]-3-oxo-2-(phenylmethoxycarbonylamino)propyl]disulfanyl]-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetate|Ethyl 8,13-bis{[(benzyloxy)carbonyl]amino}-4,7,14-trioxo-3-oxa-10,11-dithia-6,15-diazaheptadecan-17-oate
| Molecular Formula | C30H38N4O10S2 |
|---|---|
| Molecular Weight | 678.20294 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 238.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 23 |
| Exact Mass | 678.20294 |
| Monoisotopic Mass | 678.20294 |
| Heavy Atoms | 46 |
| Complexity | 901.0 |
Chemical Identifiers
| CAS Number | 2790-85-4 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)C(CSSCC(C(=O)NCC(=O)OCC)NC(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2 |
| InChIKey | XOIIILVRJLWDPB-UHFFFAOYSA-N |
Product Overview
AC1L9NU7 (CAS 2790-85-4), with molecular formula C30H38N4O10S2 and molecular weight 678.20294 g/mol. IUPAC: ethyl 2-[[3-[[3-[(2-ethoxy-2-oxoethyl)amino]-3-oxo-2-(phenylmethoxycarbonylamino)propyl]disulfanyl]-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetate.
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