SID:53790965
TL;DR: SID:53790965 (CAS 188844-52-2) is a chemical compound with molecular formula C28H27NO2S and molecular weight 441.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(7,7,10,10-tetramethyl-8,9-dihydronaphtho[2,3-b][1,5]benzothiazepin-12-yl)benzoic acid
Also Known As: SID:53790965, J1.478.436E, Benzoic acid, 4-(7,8,9,10-tetrahydro-7,7,10,10-tetramethylbenzo(b)naphtho(2,3-f)(1,4)thiazepin-12-yl)-, 4-(7,7,10,10-tetramethyl-8,9-dihydronaphtho[2,3-b][1,5]benzothiazepin-12-yl)benzoic acid, 4-(7,8,9,10-tetrahydro-7,7,10,10-tetramethylbenzo[b]naphtho[2,3-f][1,4]thiazepin-12-yl)benzoic Acid
| Molecular Formula | C28H27NO2S |
|---|---|
| Molecular Weight | 441.18 g/mol |
| LogP | 7.3675 |
| Topological Polar Surface Area | 49.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 441.17624 |
| Heavy Atoms | 32 |
| Complexity | 1269.09 |
Chemical Identifiers
| CAS Number | 188844-52-2 |
|---|---|
| SMILES | CC1(CCC(C2=C1C=C3C(=C2)SC4=CC=CC=C4N=C3C5=CC=C(C=C5)C(=O)O)(C)C)C |
Product Overview
SID:53790965 (CAS 188844-52-2), with molecular formula C28H27NO2S and molecular weight 441.18 g/mol. IUPAC: 4-(7,7,10,10-tetramethyl-8,9-dihydronaphtho[2,3-b][1,5]benzothiazepin-12-yl)benzoic acid.
Chemical Property Profile of SID:53790965
Property Insights of SID:53790965
The XLogP value of 7.3675 indicates that SID:53790965 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.66 Ų, SID:53790965 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, SID:53790965 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SID:53790965?
The CAS number of SID:53790965 is 188844-52-2.
What is the molecular formula of SID:53790965?
The molecular formula of SID:53790965 is C28H27NO2S.
What is the molecular weight of SID:53790965?
The molecular weight of SID:53790965 is 441.18 g/mol.
Where can I buy SID:53790965?
You can request a quote for SID:53790965 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SID:53790965?
Yes, KEHONG BIO provides custom synthesis services for SID:53790965 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.