C29H24N6O3S
TL;DR: C29H24N6O3S (CAS 1650570-59-4) is a chemical compound with molecular formula C29H24N6O3S and molecular weight 536.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(11Z)-4,6-dimethyl-11-(1-methyl-2-oxoindol-3-ylidene)-3,7-diphenyl-10-thia-1,2,4,6,8-pentazatricyclo[7.3.0.03,7]dodec-8-ene-5,12-dione
Also Known As: A2162/0090819, (Z)-1,3-dimethyl-6-(1-methyl-2-oxoindolin-3-ylidene)-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione, (6Z)-1,3-dimethyl-6-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione, 1,3-dimethyl-6-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-yliden)-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H)-dione
| Molecular Formula | C29H24N6O3S |
|---|---|
| Molecular Weight | 536.16 g/mol |
| LogP | 1.9651 |
| Topological Polar Surface Area | 90.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 536.1631 |
| Heavy Atoms | 39 |
| Complexity | 1868.1097 |
Chemical Identifiers
| CAS Number | 1650570-59-4 |
|---|---|
| SMILES | CN1C2=CC=CC=C2/C(=C/3\C(=O)N4C(=NC5(C(N4)(N(C(=O)N5C)C)C6=CC=CC=C6)C7=CC=CC=C7)S3)/C1=O |
Product Overview
C29H24N6O3S (CAS 1650570-59-4), with molecular formula C29H24N6O3S and molecular weight 536.16 g/mol. IUPAC: (11Z)-4,6-dimethyl-11-(1-methyl-2-oxoindol-3-ylidene)-3,7-diphenyl-10-thia-1,2,4,6,8-pentazatricyclo[7.3.0.03,7]dodec-8-ene-5,12-dione.
Chemical Property Profile of C29H24N6O3S
Property Insights of C29H24N6O3S
The XLogP value of 1.9651 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C29H24N6O3S. The TPSA of 90.25 Ų falls within the moderate polarity range, balancing permeability and solubility for C29H24N6O3S. Following Lipinski's Rule of Five, C29H24N6O3S has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C29H24N6O3S?
The CAS number of C29H24N6O3S is 1650570-59-4.
What is the molecular formula of C29H24N6O3S?
The molecular formula of C29H24N6O3S is C29H24N6O3S.
What is the molecular weight of C29H24N6O3S?
The molecular weight of C29H24N6O3S is 536.16 g/mol.
Where can I buy C29H24N6O3S?
You can request a quote for C29H24N6O3S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C29H24N6O3S?
Yes, KEHONG BIO provides custom synthesis services for C29H24N6O3S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.