VU0206471-3
TL;DR: VU0206471-3 (CAS 372976-14-2) is a chemical compound with molecular formula C22H29N5O2S and molecular weight 427.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-N-(2-methylpropyl)-8-morpholin-4-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-amine
Also Known As: VU0206471-3, AL-281/40711523, N-isobutyl-2,2-dimethyl-5-morpholino-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine, (2,2-Dimethyl-5-morpholin-4-yl-1,4-dihydro-2H-3-oxa-7-thia-6,9,11-triaza-benzo[c]fluoren-8-yl)-isobutyl- amine, 2,2-dimethyl-N-(2-methylpropyl)-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
| Molecular Formula | C22H29N5O2S |
|---|---|
| Molecular Weight | 427.20 g/mol |
| LogP | 3.9953 |
| Topological Polar Surface Area | 72.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 427.2042 |
| Heavy Atoms | 30 |
| Complexity | 1088.2517 |
Chemical Identifiers
| CAS Number | 372976-14-2 |
|---|---|
| SMILES | CC(C)CNC1=NC=NC2=C1SC3=C2C4=C(COC(C4)(C)C)C(=N3)N5CCOCC5 |
Product Overview
VU0206471-3 (CAS 372976-14-2), with molecular formula C22H29N5O2S and molecular weight 427.20 g/mol. IUPAC: 4,4-dimethyl-N-(2-methylpropyl)-8-morpholin-4-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-amine.
Chemical Property Profile of VU0206471-3
Property Insights of VU0206471-3
The XLogP value of 3.9953 indicates that VU0206471-3 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 VU0206471-3. Following Lipinski's Rule of Five, VU0206471-3 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 VU0206471-3?
The CAS number of VU0206471-3 is 372976-14-2.
What is the molecular formula of VU0206471-3?
The molecular formula of VU0206471-3 is C22H29N5O2S.
What is the molecular weight of VU0206471-3?
The molecular weight of VU0206471-3 is 427.20 g/mol.
Where can I buy VU0206471-3?
You can request a quote for VU0206471-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0206471-3?
Yes, KEHONG BIO provides custom synthesis services for VU0206471-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.