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72912-00-6 | 1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diacetamide
CAS No: 72912-00-6 Catalog No: AG005DZT MDL No:
Product Description
Catalog Number:
AG005DZT
Chemical Name:
1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diacetamide
CAS Number:
72912-00-6
Molecular Formula:
C16H32N4O6
Molecular Weight:
376.4485
IUPAC Name:
2-[16-(2-amino-2-oxoethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]acetamide
InChI:
InChI=1S/C16H32N4O6/c17-15(21)13-19-1-5-23-9-10-25-7-3-20(14-16(18)22)4-8-26-12-11-24-6-2-19/h1-14H2,(H2,17,21)(H2,18,22)
InChI Key:
AXUHNKFJBCTBFC-UHFFFAOYSA-N
SMILES:
NC(=O)CN1CCOCCOCCN(CCOCCOCC1)CC(=O)N
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.232g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
376.454g/mol
Monoisotopic Mass:
376.232g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.6
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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