dAVP
N-[1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-1-[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-benzyl-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide
Also Known As: DESMOPRESSIN, DDAVP, Adiuretin, dAVP, desnopressin, Desmopressinum, Minirin, Noctiva, deamino-vasopressin, Minrin Melt, Adiuretin SD, [deamino1]AVP, Desmopressin Melt, Desmopressinacetate, [deamino-Cys1]AVP
| Molecular Formula | C46H64N14O12S2 |
|---|---|
| Molecular Weight | 1068.427 g/mol |
| LogP | -4.34 |
| Topological Polar Surface Area | 437.91 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 19 |
| Exact Mass | 1068.427 |
| Heavy Atoms | 74 |
| Complexity | 2378 |
Chemical Identifiers
| CAS Number | 16679-58-6 |
|---|---|
| SMILES | C1CC(N(C1)C(=O)C2CSSCCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N2)CC(=O)N)CCC(=O)N)CC3=CC=CC=C3)CC4=CC=C(C=C4)O)C(=O)NC(CCCN=C(N)N)C(=O)NCC(=O)N |
Product Overview
dAVP (CAS 16679-58-6), with molecular formula C46H64N14O12S2 and molecular weight 1068.427 g/mol. IUPAC: N-[1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-1-[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-benzyl-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide.
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