1-Homodistamycin A
TL;DR: 1-Homodistamycin A (CAS 85406-98-0) is a chemical compound with molecular formula C23H29N9O4 and molecular weight 495.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-amino-3-iminopropyl)-4-[[4-[(1-ethyl-4-formamidopyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carboxamide
Also Known As: 1-Homodistamycin A, 1H-Pyrrole-2-carboxamide, N-(5-(((3-amino-3-iminopropyl)amino)carboxyl)-1-methyl-1H-pyrrol-3-yl)-4-(((1-ethyl-4-(formylamino)-1H-pyrrol-2-yl)carbonyl)amino)-1-methyl-, N-(3-amino-3-iminopropyl)-4-[[4-[(1-ethyl-4-formamidopyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carboxamide, N-(3-amino-3-iminopropyl)-4-((4-((1-ethyl-4-formamidopyrrole-2-carbonyl)amino)-1-methylpyrrole-2-carbonyl)amino)-1-methylpyrrole-2-carboxamide, N-[5-({5-[(3-Amino-3-iminopropyl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]-1-ethyl-4-formamido-1H-pyrrole-2-carboxamide
| Molecular Formula | C23H29N9O4 |
|---|---|
| Molecular Weight | 495.23 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 181.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 495.23425 |
| Heavy Atoms | 36 |
| Complexity | 840.0 |
Chemical Identifiers
| CAS Number | 85406-98-0 |
|---|---|
| SMILES | CCN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCC(=N)N)C)C)NC=O |
| InChIKey | QUJQOOPOPXECLL-UHFFFAOYSA-N |
Product Overview
1-Homodistamycin A (CAS 85406-98-0), with molecular formula C23H29N9O4 and molecular weight 495.23 g/mol. IUPAC: N-(3-amino-3-iminopropyl)-4-[[4-[(1-ethyl-4-formamidopyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carboxamide.
Chemical Property Profile of 1-Homodistamycin A
Property Insights of 1-Homodistamycin A
The XLogP value of -1.5 indicates that 1-Homodistamycin A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 181.0 Ų indicates high polarity, suggesting 1-Homodistamycin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Homodistamycin A has 6 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Homodistamycin A?
The CAS number of 1-Homodistamycin A is 85406-98-0.
What is the molecular formula of 1-Homodistamycin A?
The molecular formula of 1-Homodistamycin A is C23H29N9O4.
What is the molecular weight of 1-Homodistamycin A?
The molecular weight of 1-Homodistamycin A is 495.23 g/mol.
Where can I buy 1-Homodistamycin A?
You can request a quote for 1-Homodistamycin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Homodistamycin A?
Yes, KEHONG BIO provides custom synthesis services for 1-Homodistamycin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.