Methylpendolmycin
TL;DR: Methylpendolmycin (CAS 138590-60-0) is a chemical compound with molecular formula C23H33N3O2 and molecular weight 383.25726 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(13S)-10-butan-2-yl-13-(hydroxymethyl)-9-methyl-5-(2-methylbut-3-en-2-yl)-3,9,12-triazatricyclo[6.6.1.04,15]pentadeca-1,4,6,8(15)-tetraen-11-one
Also Known As: Methylpendolmycin, (13S)-10-Butan-2-yl-13-(hydroxymethyl)-9-methyl-5-(2-methylbut-3-en-2-yl)-3,9,12-triazatricyclo[6.6.1.04,15]pentadeca-1,4,6,8(15)-tetraen-11-one, (5S)-2-(Butan-2-yl)-5-(hydroxymethyl)-1-methyl-9-(2-methylbut-3-en-2-yl)-2,5,6,8-tetrahydro-1H-[1,4]diazonino[7,6,5-cd]indol-3-ol, 2-(Butan-2-yl)-5-(hydroxymethyl)-1-methyl-9-(2-methylbut-3-en-2-yl)-2,5,6,8-tetrahydro-1H-[1,4]diazonino[7,6,5-cd]indol-3-ol, 3H-Pyrrolo(4,3,2-gh)-1,4-benzodiazonin-3-one, 9-(1,1-dimethyl-2-propenyl)-1,2,4,5,6,8-hexahydro-5-(hydroxymethyl)-1-methyl-2-(1-methylpropyl)-, (2S-(2R*(R*),5R*))-
Technical Specifications
| Molecular Formula | C23H33N3O2 |
| Molecular Weight | 383.25726 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 68.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.25726 Da |
| Heavy Atoms | 28 |
| Complexity | 578.0 |
| SMILES | CCC(C)C1C(=O)N[C@@H](CC2=CNC3=C(C=CC(=C23)N1C)C(C)(C)C=C)CO |
| InChIKey | DALRIICDQKRRFF-PKAMJGAUSA-N |
Chemical Property Profile of Methylpendolmycin
Property Insights of Methylpendolmycin
The XLogP value of 4.6 indicates that Methylpendolmycin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Methylpendolmycin. Following Lipinski's Rule of Five, Methylpendolmycin has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methylpendolmycin?
The CAS number of Methylpendolmycin is 138590-60-0.
What is the molecular formula of Methylpendolmycin?
The molecular formula of Methylpendolmycin is C23H33N3O2.
What is the molecular weight of Methylpendolmycin?
The molecular weight of Methylpendolmycin is 383.25726 g/mol.
Where can I buy Methylpendolmycin?
You can request a quote for Methylpendolmycin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methylpendolmycin?
Yes, CoreyChem provides custom synthesis services for Methylpendolmycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.