BAS 02101794
TL;DR: BAS 02101794 (CAS 333307-84-9) is a chemical compound with molecular formula C27H29N3O2 and molecular weight 427.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[4-(diethylamino)phenyl]-6-(furan-2-yl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 02101794, 9-[4-(diethylamino)phenyl]-6-(furan-2-yl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one, 3-(4-(diethylamino)phenyl)-11-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 3-[4-(DIETHYLAMINO)PHENYL]-11-(2-FURYL)-2,3,4,5,10,11-HEXAHYDRO-1H-DIBENZO[B,E][1,4]DIAZEPIN-1-ONE, 3-[4-(diethylamino)phenyl]-11-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
| Molecular Formula | C27H29N3O2 |
|---|---|
| Molecular Weight | 427.23 g/mol |
| LogP | 6.1053 |
| Topological Polar Surface Area | 57.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.22598 |
| Heavy Atoms | 32 |
| Complexity | 1127.9729 |
Chemical Identifiers
| CAS Number | 333307-84-9 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC=CO5)C(=O)C2 |
Product Overview
BAS 02101794 (CAS 333307-84-9), with molecular formula C27H29N3O2 and molecular weight 427.23 g/mol. IUPAC: 9-[4-(diethylamino)phenyl]-6-(furan-2-yl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 02101794
Property Insights of BAS 02101794
The XLogP value of 6.1053 indicates that BAS 02101794 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.51 Ų, BAS 02101794 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02101794 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02101794?
The CAS number of BAS 02101794 is 333307-84-9.
What is the molecular formula of BAS 02101794?
The molecular formula of BAS 02101794 is C27H29N3O2.
What is the molecular weight of BAS 02101794?
The molecular weight of BAS 02101794 is 427.23 g/mol.
Where can I buy BAS 02101794?
You can request a quote for BAS 02101794 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02101794?
Yes, KEHONG BIO provides custom synthesis services for BAS 02101794 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.