BAS 01506808
TL;DR: BAS 01506808 (CAS 309923-55-5) is a chemical compound with molecular formula C28H22N2O2S and molecular weight 450.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Also Known As: BAS 01506808, A2276/0095907, 2-(12,14-dioxo-11,12,14,15-tetrahydro-9H-9,10-[3,4]epipyrroloanthracen-13(10H)-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile, 2-(16,18-dioxo-17-azapentacyclo[6.6.5.0<2,7>.0<9,14>.0<15,19>]nonadeca-2(7),3, 5,9(14),10,12-hexaen-17-yl)-4,5,6,7,8-pentahydrocyclohepta[1,2-b]thiophene-3-c arbonitrile, 2-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
| Molecular Formula | C28H22N2O2S |
|---|---|
| Molecular Weight | 450.14 g/mol |
| LogP | 5.28528 |
| Topological Polar Surface Area | 61.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 450.1402 |
| Heavy Atoms | 33 |
| Complexity | 1281.6191 |
Chemical Identifiers
| CAS Number | 309923-55-5 |
|---|---|
| SMILES | C1CCC2=C(CC1)SC(=C2C#N)N3C(=O)C4C(C3=O)C5C6=CC=CC=C6C4C7=CC=CC=C57 |
Product Overview
BAS 01506808 (CAS 309923-55-5), with molecular formula C28H22N2O2S and molecular weight 450.14 g/mol. IUPAC: 2-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile.
Chemical Property Profile of BAS 01506808
Property Insights of BAS 01506808
The XLogP value of 5.28528 indicates that BAS 01506808 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.17 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01506808. Following Lipinski's Rule of Five, BAS 01506808 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01506808?
The CAS number of BAS 01506808 is 309923-55-5.
What is the molecular formula of BAS 01506808?
The molecular formula of BAS 01506808 is C28H22N2O2S.
What is the molecular weight of BAS 01506808?
The molecular weight of BAS 01506808 is 450.14 g/mol.
Where can I buy BAS 01506808?
You can request a quote for BAS 01506808 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01506808?
Yes, KEHONG BIO provides custom synthesis services for BAS 01506808 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.