Cambridge id 6966072
TL;DR: Cambridge id 6966072 (CAS 378767-36-3) is a chemical compound with molecular formula C21H27N5O2S and molecular weight 413.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5,13-trimethyl-N-(2-morpholin-4-ylethyl)-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11,13,15-hexaen-15-amine
Also Known As: ChemDiv3_003932, BAS 04056937, IDI1_021842, AJ-292/41083293, BRD-K35019363-001-01-3
| Molecular Formula | C21H27N5O2S |
|---|---|
| Molecular Weight | 413.19 g/mol |
| LogP | 3.14332 |
| Topological Polar Surface Area | 72.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.18854 |
| Heavy Atoms | 29 |
| Complexity | 1058.3279 |
Chemical Identifiers
| CAS Number | 378767-36-3 |
|---|---|
| SMILES | CC1=NC2=C(C(=N1)NCCN3CCOCC3)SC4=C2C=C5COC(CC5=N4)(C)C |
Product Overview
Cambridge id 6966072 (CAS 378767-36-3), with molecular formula C21H27N5O2S and molecular weight 413.19 g/mol. IUPAC: 5,5,13-trimethyl-N-(2-morpholin-4-ylethyl)-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11,13,15-hexaen-15-amine.
Chemical Property Profile of Cambridge id 6966072
Property Insights of Cambridge id 6966072
The XLogP value of 3.14332 indicates that Cambridge id 6966072 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Cambridge id 6966072. Following Lipinski's Rule of Five, Cambridge id 6966072 has 1 hydrogen bond donor(s) and 8 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 Cambridge id 6966072?
The CAS number of Cambridge id 6966072 is 378767-36-3.
What is the molecular formula of Cambridge id 6966072?
The molecular formula of Cambridge id 6966072 is C21H27N5O2S.
What is the molecular weight of Cambridge id 6966072?
The molecular weight of Cambridge id 6966072 is 413.19 g/mol.
Where can I buy Cambridge id 6966072?
You can request a quote for Cambridge id 6966072 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 6966072?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 6966072 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.