Tan 999
TL;DR: Tan 999 (CAS 126221-75-8) is a chemical compound with molecular formula C29H26N4O4 and molecular weight 494.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,24-dimethoxy-2-methyl-4-methylimino-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21(26),22,24,27-nonaen-16-one
Also Known As: Tan 999, 3,24-dimethoxy-2-methyl-4-methylimino-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21(26),22,24,27-nonaen-16-one, 9,13-Epoxy-1H,9H-diindolo(1,2,3-gh:3',2',1'-lm)pyrrolo(3,4-j)(1,7)benzodiazonin-1-one, 2,3,10,11,12,13-hexahydro-6,10-dimethoxy-9-methyl-11-(methylimino)-, 8,11-Dimethoxy-9-methyl-7-(methylimino)-6,7,8,9-tetrahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-16-ol
| Molecular Formula | C29H26N4O4 |
|---|---|
| Molecular Weight | 494.20 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 79.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 494.1954 |
| Heavy Atoms | 37 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 126221-75-8 |
|---|---|
| SMILES | CC12C(C(=NC)CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=C(N2C7=C53)C=C(C=C8)OC)CNC6=O)OC |
| InChIKey | ZXQPCJUWQQAWKY-UHFFFAOYSA-N |
Product Overview
Tan 999 (CAS 126221-75-8), with molecular formula C29H26N4O4 and molecular weight 494.20 g/mol. IUPAC: 3,24-dimethoxy-2-methyl-4-methylimino-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21(26),22,24,27-nonaen-16-one.
Chemical Property Profile of Tan 999
Property Insights of Tan 999
The XLogP value of 3.1 indicates that Tan 999 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Tan 999. Following Lipinski's Rule of Five, Tan 999 has 1 hydrogen bond donor(s) and 5 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 Tan 999?
The CAS number of Tan 999 is 126221-75-8.
What is the molecular formula of Tan 999?
The molecular formula of Tan 999 is C29H26N4O4.
What is the molecular weight of Tan 999?
The molecular weight of Tan 999 is 494.20 g/mol.
Where can I buy Tan 999?
You can request a quote for Tan 999 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tan 999?
Yes, KEHONG BIO provides custom synthesis services for Tan 999 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.