7-formylcamptothecin
TL;DR: 7-formylcamptothecin (CAS 80758-83-4) is a chemical compound with molecular formula C21H16N2O5 and molecular weight 376.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(19S)-19-ethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-10-carbaldehyde
Also Known As: 7-formylcamptothecin, 7-formyl CPT, camptothecin-7-aldehyde, (S)-11-Formyl-4-ethyl-4-hydroxy-1,12-dihydro-4h-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione, -diaza-dibenzo[b,h]fluorene-3,13-dione
| Molecular Formula | C21H16N2O5 |
|---|---|
| Molecular Weight | 376.11 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 96.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.10593 |
| Heavy Atoms | 28 |
| Complexity | 818.0 |
Chemical Identifiers
| CAS Number | 80758-83-4 |
|---|---|
| SMILES | CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C(C5=CC=CC=C5N=C4C3=C2)C=O)O |
| InChIKey | XKIDBQHJMYSFPX-NRFANRHFSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-formylcamptothecin (CAS 80758-83-4), with molecular formula C21H16N2O5 and molecular weight 376.11 g/mol. IUPAC: (19S)-19-ethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-10-carbaldehyde.
Chemical Property Profile of 7-formylcamptothecin
Property Insights of 7-formylcamptothecin
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-formylcamptothecin. The TPSA of 96.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-formylcamptothecin. Following Lipinski's Rule of Five, 7-formylcamptothecin has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-formylcamptothecin?
The CAS number of 7-formylcamptothecin is 80758-83-4.
What is the molecular formula of 7-formylcamptothecin?
The molecular formula of 7-formylcamptothecin is C21H16N2O5.
What is the molecular weight of 7-formylcamptothecin?
The molecular weight of 7-formylcamptothecin is 376.11 g/mol.
Where can I buy 7-formylcamptothecin?
You can request a quote for 7-formylcamptothecin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-formylcamptothecin?
Yes, KEHONG BIO provides custom synthesis services for 7-formylcamptothecin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.