![but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione structure](/static/products/1441/144181-12-4.webp)
but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione
TL;DR: but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione (CAS 144181-12-4) is a chemical compound with molecular formula C28H33N3O8 and molecular weight 539.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;1-[[3-(diethylamino)-2-hydroxypropyl]amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione
Also Known As: but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione, 1-((3-(Diethylamino)-2-hydroxypropyl)amino)-4-((2,3-epoxypropyl)amino)-9,10-anthracenedione fumaric acid salt, but-2-enedioic acid;1-[[3-(diethylamino)-2-hydroxypropyl]amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione
| Molecular Formula | C28H33N3O8 |
|---|---|
| Molecular Weight | 539.23 g/mol |
| LogP | 2.0991 |
| Topological Polar Surface Area | 169.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 539.22675 |
| Heavy Atoms | 39 |
| Complexity | 759.0 |
Chemical Identifiers
| CAS Number | 144181-12-4 |
|---|---|
| SMILES | CCN(CC)CC(CNC1=C2C(=C(C=C1)NCC3CO3)C(=O)C4=CC=CC=C4C2=O)O.C(=CC(=O)O)C(=O)O |
| InChIKey | BREXYFHGCPUYSM-UHFFFAOYSA-N |
Product Overview
but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione (CAS 144181-12-4), with molecular formula C28H33N3O8 and molecular weight 539.23 g/mol. IUPAC: but-2-enedioic acid;1-[[3-(diethylamino)-2-hydroxypropyl]amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione.
Chemical Property Profile of but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione
Property Insights of but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione
The XLogP value of 2.0991 suggests moderate lipophilicity, balancing water solubility and membrane permeability for but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione. The TPSA of 169.0 Ų indicates high polarity, suggesting but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione?
The CAS number of but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione is 144181-12-4.
What is the molecular formula of but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione?
The molecular formula of but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione is C28H33N3O8.
What is the molecular weight of but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione?
The molecular weight of but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione is 539.23 g/mol.
Where can I buy but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione?
You can request a quote for but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione?
Yes, KEHONG BIO provides custom synthesis services for but-2-enedioic acid; 1-[(3-diethylamino-2-hydroxy-propyl)amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.