D0K0VH
TL;DR: D0K0VH (CAS 97068-30-9) is a chemical compound with molecular formula C25H31NO4S and molecular weight 441.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-7-[(1R,2R,3R,5S)-2-[(5-hydroxy-1-benzothiophene-3-carbonyl)amino]-6,6-dimethyl-3-bicyclo[3.1.1]heptanyl]hept-5-enoic acid
Also Known As: S-5751, (Z)-7-[(1R,2R,3R,5S)-2-[(5-hydroxy1-benzothiophene-3-carbonyl)amino]-7,7-dimethyl-3-bicyclo[3.1.1]heptanyl]hept-5-enoic acid, 7(2-(5-hydroxybenzo(b)thiophen-3-ylcarbonylamino)-10-norpinan-3-yl)hept-5-enoic Acid, (Z)-7-[(1R,2R,3R,5S)-2-[(5-Hydroxy-1-benzothiophene-3-carbonyl)amino]-6,6-dimethyl-3-bicyclo[3.1.1]heptanyl]hept-5-enoic acid, (Z)-7-[(1S,3R,4R,5R)-4-[(5-hydroxy-1-benzothiophene-3-carbonyl)amino]-6,6-dimethyl-3-bicyclo[3.1.1]heptanyl]hept-5-enoic acid
| Molecular Formula | C25H31NO4S |
|---|---|
| Molecular Weight | 441.20 g/mol |
| LogP | 5.5887 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 441.1974 |
| Heavy Atoms | 31 |
| Complexity | 1008.11566 |
Chemical Identifiers
| CAS Number | 97068-30-9 |
|---|---|
| SMILES | CC1([C@H]2C[C@H]([C@H]([C@@H]1C2)NC(=O)C3=CSC4=C3C=C(C=C4)O)C/C=C\CCCC(=O)O)C |
Product Overview
D0K0VH (CAS 97068-30-9), with molecular formula C25H31NO4S and molecular weight 441.20 g/mol. IUPAC: (Z)-7-[(1R,2R,3R,5S)-2-[(5-hydroxy-1-benzothiophene-3-carbonyl)amino]-6,6-dimethyl-3-bicyclo[3.1.1]heptanyl]hept-5-enoic acid.
Chemical Property Profile of D0K0VH
Property Insights of D0K0VH
The XLogP value of 5.5887 indicates that D0K0VH is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for D0K0VH. Following Lipinski's Rule of Five, D0K0VH has 3 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 D0K0VH?
The CAS number of D0K0VH is 97068-30-9.
What is the molecular formula of D0K0VH?
The molecular formula of D0K0VH is C25H31NO4S.
What is the molecular weight of D0K0VH?
The molecular weight of D0K0VH is 441.20 g/mol.
Where can I buy D0K0VH?
You can request a quote for D0K0VH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D0K0VH?
Yes, KEHONG BIO provides custom synthesis services for D0K0VH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.