2-[Bis[2-[bis[2-(tert-butoxy)-2-oxoethyl]amino]ethyl]amino]acetic Acid - CAS 174267-71-1
Catalog: |
BB012999 |
Product Name: |
2-[Bis[2-[bis[2-(tert-butoxy)-2-oxoethyl]amino]ethyl]amino]acetic Acid |
CAS: |
174267-71-1 |
Synonyms: |
2-[bis[2-[bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]ethyl]amino]acetic acid; 2-[bis[2-[bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]ethyl]amino]acetic acid |
IUPAC Name: | 2-[bis[2-[bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]ethyl]amino]acetic acid |
Description: | 2-[Bis[2-[bis[2-(tert-butoxy)-2-oxoethyl]amino]ethyl]amino]acetic Acid (CAS# 174267-71-1) is a bifunctional chelating agent. |
Molecular Weight: | 617.77 |
Molecular Formula: | C30H55N3O10 |
Canonical SMILES: | CC(C)(C)OC(=O)CN(CCN(CCN(CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)CC(=O)O)CC(=O)OC(C)(C)C |
InChI: | InChI=1S/C30H55N3O10/c1-27(2,3)40-23(36)18-32(19-24(37)41-28(4,5)6)15-13-31(17-22(34)35)14-16-33(20-25(38)42-29(7,8)9)21-26(39)43-30(10,11)12/h13-21H2,1-12H3,(H,34,35) |
InChI Key: | YOAXKQZNUYOPFL-UHFFFAOYSA-N |
LogP: | 2.34380 |
Publication Number | Title | Priority Date |
EP-2451776-A2 | N-alkoxyamide conjugates as imaging agents | 20090708 |
EP-2451776-B1 | N-alkoxyamide conjugates as imaging agents | 20090708 |
US-2012328514-A1 | N-alkoxyamide conjugates as imaging agents | 20090708 |
US-2015078997-A1 | N-alkoxyamide conjugates as imaging agents | 20090708 |
US-8877157-B2 | N-alkoxyamide conjugates as imaging agents | 20090708 |
PMID | Publication Date | Title | Journal |
22619538 | 20120101 | Peptide-modified liposomes for selective targeting of bombesin receptors overexpressed by cancer cells: a potential theranostic agent | International journal of nanomedicine |
17640034 | 20070701 | Molecular recognition of sugars by lanthanide (III) complexes of a conjugate of N, N-bis[2-[bis[2-(1, 1-dimethylethoxy)-2-oxoethyl]amino]ethyl]glycine and phenylboronic acid | Contrast media & molecular imaging |
Complexity: | 812 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 617.38874496 |
Formal Charge: | 0 |
Heavy Atom Count: | 43 |
Hydrogen Bond Acceptor Count: | 13 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 617.38874496 |
Rotatable Bond Count: | 24 |
Topological Polar Surface Area: | 152 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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