BAS 12290706
TL;DR: BAS 12290706 (CAS 777868-31-2) is a chemical compound with molecular formula C22H21N5O2 and molecular weight 387.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzoxazol-2-ylamino)-7,7-dimethyl-4-pyridin-3-yl-1,4,6,8-tetrahydroquinazolin-5-one
Also Known As: BAS 12290706, 2-(1,3-benzoxazol-2-ylamino)-7,7-dimethyl-4-(pyridin-3-yl)-4,6,7,8-tetrahydroquinazolin-5-ol, 2-(1,3-benzoxazol-2-ylamino)-7,7-dimethyl-4-(pyridin-3-yl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one, 2-(1,3-benzoxazol-2-ylamino)-7,7-dimethyl-4-pyridin-3-yl-1,4,6,8-tetrahydroquinazolin-5-one, 2-(benzo[d]oxazol-2-ylamino)-7,7-dimethyl-4-(pyridin-3-yl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
| Molecular Formula | C22H21N5O2 |
|---|---|
| Molecular Weight | 387.17 g/mol |
| LogP | 3.9784 |
| Topological Polar Surface Area | 92.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 387.16953 |
| Heavy Atoms | 29 |
| Complexity | 1127.1741 |
Chemical Identifiers
| CAS Number | 777868-31-2 |
|---|---|
| SMILES | CC1(CC2=C(C(N=C(N2)NC3=NC4=CC=CC=C4O3)C5=CN=CC=C5)C(=O)C1)C |
Product Overview
BAS 12290706 (CAS 777868-31-2), with molecular formula C22H21N5O2 and molecular weight 387.17 g/mol. IUPAC: 2-(1,3-benzoxazol-2-ylamino)-7,7-dimethyl-4-pyridin-3-yl-1,4,6,8-tetrahydroquinazolin-5-one.
Chemical Property Profile of BAS 12290706
Property Insights of BAS 12290706
The XLogP value of 3.9784 indicates that BAS 12290706 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.41 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12290706. Following Lipinski's Rule of Five, BAS 12290706 has 2 hydrogen bond donor(s) and 7 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 BAS 12290706?
The CAS number of BAS 12290706 is 777868-31-2.
What is the molecular formula of BAS 12290706?
The molecular formula of BAS 12290706 is C22H21N5O2.
What is the molecular weight of BAS 12290706?
The molecular weight of BAS 12290706 is 387.17 g/mol.
Where can I buy BAS 12290706?
You can request a quote for BAS 12290706 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12290706?
Yes, KEHONG BIO provides custom synthesis services for BAS 12290706 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.