Bagougeramine B
TL;DR: Bagougeramine B (CAS 104840-34-8) is a chemical compound with molecular formula C24H44N12O7 and molecular weight 612.3456 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3S,4S,5R,6R)-N-[3-(4-aminobutylamino)propyl]-6-(4-amino-2-oxopyrimidin-1-yl)-3-[[(2R)-3-(diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]propanoyl]amino]-4,5-dihydroxyoxane-2-carboxamide
Also Known As: Bagougeramine B, (2S,3S,4S,5R,6R)-N-[3-(4-aminobutylamino)propyl]-6-(4-amino-2-oxopyrimidin-1-yl)-3-[[(2R)-3-(diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]propanoyl]amino]-4,5-dihydroxyoxane-2-carboxamide, beta-D-Glucopyranuronamide, N-(3-((4-aminobutyl)amino)propyl)-4-((3-((aminoiminomethyl)amino)-N-(N-methylglycyl)-D-alanyl)amino)-1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,4-dideoxy-, (2S,3S,4S,5R,6R)-6-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-N-{3-[(4-aminobutyl)amino]propyl}-3-[(2R)-3-carbamimidamido-2-[2-(methylamino)acetamido]propanamido]-4,5-dihydroxyoxane-2-carboxamide, (2S,3S,4S,5R,6R)-N-(3-(4-aminobutylamino)propyl)-6-(4-amino-2-oxopyrimidin-1-yl)-3-(((2R)-3-(diaminomethylideneamino)-2-((2-(methylamino)acetyl)amino)propanoyl)amino)-4,5-dihydroxyoxane-2-carboxamide
Technical Specifications
| Molecular Formula | C24H44N12O7 |
| Molecular Weight | 612.3456 g/mol |
| XLogP | -6.1 |
| Topological Polar Surface Area (TPSA) | 310.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 17 |
| Exact Mass | 612.3456 Da |
| Heavy Atoms | 43 |
| Complexity | 1050.0 |
| SMILES | CNCC(=O)N[C@H](CN=C(N)N)C(=O)N[C@H]1[C@@H]([C@H]([C@@H](O[C@@H]1C(=O)NCCCNCCCCN)N2C=CC(=NC2=O)N)O)O |
| InChIKey | LCASODQCASDDLN-WEYBRJQASA-N |
Chemical Property Profile of Bagougeramine B
Property Insights of Bagougeramine B
The XLogP value of -6.1 indicates that Bagougeramine B is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 310.0 Ų indicates high polarity, suggesting Bagougeramine B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bagougeramine B has 11 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Bagougeramine B?
The CAS number of Bagougeramine B is 104840-34-8.
What is the molecular formula of Bagougeramine B?
The molecular formula of Bagougeramine B is C24H44N12O7.
What is the molecular weight of Bagougeramine B?
The molecular weight of Bagougeramine B is 612.3456 g/mol.
Where can I buy Bagougeramine B?
You can request a quote for Bagougeramine B directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bagougeramine B?
Yes, CoreyChem provides custom synthesis services for Bagougeramine B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.