7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione

C18H36N4O8 — CID 23422517

IUPAC7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione
SMILESO=C1CCNCCOCCOCCNCCC(=O)N(O)CCOCCOCCN1O
InChIInChI=1S/C18H36N4O8/c23-17-1-3-19-5-9-27-13-14-28-10-6-20-4-2-18(24)22(26)8-12-30-16-15-29-11-7-21(17)25/h19-20,25-26H,1-16H2
InChIKeyQMNXPZPSKXIWQW-UHFFFAOYSA-N
MW436.51 g/mol
LogP-1.54
Rot. Bonds

About 7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione

7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione (PubChem CID 23422517) has the molecular formula C18H36N4O8 and a molecular weight of 436.51 g/mol. Its IUPAC name is 7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione.

Molecular Properties

Compound Name7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione
PubChem CID23422517
Molecular FormulaC18H36N4O8
Molecular Weight436.51 g/mol
Exact Mass436.25
IUPAC Name7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione
SMILESO=C1CCNCCOCCOCCNCCC(=O)N(O)CCOCCOCCN1O
InChIInChI=1S/C18H36N4O8/c23-17-1-3-19-5-9-27-13-14-28-10-6-20-4-2-18(24)22(26)8-12-30-16-15-29-11-7-21(17)25/h19-20,25-26H,1-16H2
InChIKeyQMNXPZPSKXIWQW-UHFFFAOYSA-N
XLogP-1.54
TPSA142.06 Ų
H-Bond Donors4
H-Bond Acceptors10
Rotatable Bonds
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.51
LogP ≤ 5-1.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione?
The IUPAC name of 7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione (CID 23422517) is 7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione.
What is the SMILES notation for 7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione?
The canonical SMILES for 7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione is O=C1CCNCCOCCOCCNCCC(=O)N(O)CCOCCOCCN1O.
What is the InChIKey of 7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione?
The InChIKey is QMNXPZPSKXIWQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N4O8/c23-17-1-3-19-5-9-27-13-14-28-10-6-20-4-2-18(24)22(26)8-12-30-16-15-29-11-7-21(17)25/h19-20,25-26H,1-16H2.
What are the key properties of 7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione?
7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione has a molecular weight of 436.51 g/mol, XLogP of -1.54, 0 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 7,24-dihydroxy-1,4,14,17-tetraoxa-7,11,20,24-tetrazacyclohexacosane-8,23-dione is sourced from PubChem (CID 23422517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).