BAS 01022381
TL;DR: BAS 01022381 (CAS 136800-75-4) is a chemical compound with molecular formula C13H9BrN2O3S and molecular weight 351.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-bromo-15-hydroxy-5-oxa-17-thia-2,8-diazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),2,11(16),12,14-pentaen-9-one
Also Known As: BAS 01022381, AH-357/02163025, 9-Bromo-10-hydroxy-3,4-dihydro[1]benzothieno[2',3':4,5]pyrimido[2,1-c][1,4]oxazin-6(1H)-one, 14-bromo-15-hydroxy-5-oxa-17-thia-2,8-diazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),2,11(16),12,14-pentaen-9-one, 14-bromo-15-hydroxy-5-oxa-17-thia-2,8-diazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),2,11,13,15-pentaen-9-one
| Molecular Formula | C13H9BrN2O3S |
|---|---|
| Molecular Weight | 351.95 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 90.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 351.95172 |
| Heavy Atoms | 20 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 136800-75-4 |
|---|---|
| SMILES | C1COCC2=NC3=C(C4=C(S3)C(=C(C=C4)Br)O)C(=O)N21 |
| InChIKey | NFLWRXSQWMWBJH-UHFFFAOYSA-N |
Product Overview
BAS 01022381 (CAS 136800-75-4), with molecular formula C13H9BrN2O3S and molecular weight 351.95 g/mol. IUPAC: 14-bromo-15-hydroxy-5-oxa-17-thia-2,8-diazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),2,11(16),12,14-pentaen-9-one.
Chemical Property Profile of BAS 01022381
Property Insights of BAS 01022381
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01022381. The TPSA of 90.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01022381. Following Lipinski's Rule of Five, BAS 01022381 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 BAS 01022381?
The CAS number of BAS 01022381 is 136800-75-4.
What is the molecular formula of BAS 01022381?
The molecular formula of BAS 01022381 is C13H9BrN2O3S.
What is the molecular weight of BAS 01022381?
The molecular weight of BAS 01022381 is 351.95 g/mol.
Where can I buy BAS 01022381?
You can request a quote for BAS 01022381 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01022381?
Yes, KEHONG BIO provides custom synthesis services for BAS 01022381 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.