Sb-1578
(9E)-15-(2-pyrrolidin-1-ylethoxy)-7,12,26-trioxa-19,21,24-triazatetracyclo[18.3.1.12,5.114,18]hexacosa-1(24),2,4,9,14,16,18(25),20,22-nonaene
Molecular Identity
Sb-1578
(9E)-15-(2-pyrrolidin-1-ylethoxy)-7,12,26-trioxa-19,21,24-triazatetracyclo[18.3.1.12,5.114,18]hexacosa-1(24),2,4,9,14,16,18(25),20,22-nonaene
PubChem CID: 16750271
2D Structure
Properties
C26H30N4O4
Molecular Formula
462.50
Molecular Weight
g/mol
462.2267
Exact Mass
Da
2.9
XLogP
Drug-like (Lipinski: < 5)
81.9
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
8
H-Bond Acceptors
632
Complexity
SMILES
Canonical SMILES
SMILES: C1CCN(C1)CCOC2=C3COCC=CCOCC4=CC=C(O4)C5=NC(=NC=C5)NC(=C3)C=C2Isomeric SMILES
SMILES: C1CCN(C1)CCOC2=C3COC/C=C/COCC4=CC=C(O4)C5=NC(=NC=C5)NC(=C3)C=C2Synonyms(20)
937273-04-6SB-1578SB15784T71DC0G0AONX 0805ONX-0805CT-1578RefChem:181564(9E)-15-(2-(pyrrolidin-1-yl)ethoxy)-7,12,26-trioxa-19,21,24-triazatetracyclo(18.3.1.1^(2,5).1^(14,18))hexacosa-1(23),2,4,9,14,16,18(25),20(24),21-nonaeneUNII-4T71DC0G0ACHEMBL2035185SB 1578(9E)-15-(2-Pyrrolidin-1-ylethoxy)-7,12,26-trioxa-19,21,24-triazatetracyclo[18.3.1.12,5.114,18]hexacosa-1(24),2,4,9,14,16,18(25),20,22-nonaene(9E)-15-(2-(pyrrolidin-1-yl)ethoxy)-7,12,25-trioxa-19,21,24-triaza-tetracyclo[18.3.1.1(2,5).1(14,18)]hexacosa-1(24),2,4,9,14(26),15,17,20,22-nonaeneorb1741184
Data from PubChem (NCBI)
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