Pyrindamycin A
TL;DR: Pyrindamycin A (CAS 118292-36-7) is a chemical compound with molecular formula C26H26ClN3O8 and molecular weight 543.14087 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2R,8S)-8-(chloromethyl)-4-hydroxy-2-methyl-1-oxo-6-(5,6,7-trimethoxy-1H-indole-2-carbonyl)-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2-carboxylate
Also Known As: Pyrindamycin A, Duocarmycin C2, methyl (2R,8S)-8-(chloromethyl)-4-hydroxy-2-methyl-1-oxo-6-(5,6,7-trimethoxy-1H-indole-2-carbonyl)-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2-carboxylate, Benzo(1,2-b:4,3-b')dipyrrole-2-carboxylic acid, 8-(chloromethyl)-1,2,3,6,7,8-hexahydro-4-hydroxy-2-methyl-1-oxo-6-((5,6,7-trimethoxy-1H-indol-2-yl)carbonyl)-, methyl ester, (2R-trans)-, Benzo[1,2-b:4,3-b']dipyrrole-2-carboxylic acid, 8-(chloromethyl)-1,2,3,6,7,8-hexahydro-4-hydroxy-2-methyl-1-oxo-6-[(5,6,7-trimethoxy-1H-indol-2-yl)carbonyl]-, methyl ester, (2R,8S)-
Technical Specifications
| Molecular Formula | C26H26ClN3O8 |
| Molecular Weight | 543.14087 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 139.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 543.14087 Da |
| Heavy Atoms | 38 |
| Complexity | 955.0 |
| SMILES | C[C@@]1(C(=O)C2=C3[C@@H](CN(C3=CC(=C2N1)O)C(=O)C4=CC5=CC(=C(C(=C5N4)OC)OC)OC)CCl)C(=O)OC |
| InChIKey | BOGFADYROAVVTF-MZHQLVBMSA-N |
Chemical Property Profile of Pyrindamycin A
Property Insights of Pyrindamycin A
The XLogP value of 3.3 indicates that Pyrindamycin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrindamycin A. Following Lipinski's Rule of Five, Pyrindamycin A has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Pyrindamycin A?
The CAS number of Pyrindamycin A is 118292-36-7.
What is the molecular formula of Pyrindamycin A?
The molecular formula of Pyrindamycin A is C26H26ClN3O8.
What is the molecular weight of Pyrindamycin A?
The molecular weight of Pyrindamycin A is 543.14087 g/mol.
Where can I buy Pyrindamycin A?
You can request a quote for Pyrindamycin A directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pyrindamycin A?
Yes, CoreyChem provides custom synthesis services for Pyrindamycin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.