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(Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile
TL;DR: (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile (CAS 301344-10-5) is a chemical compound with molecular formula C12H11N3O and molecular weight 213.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-(1H-benzimidazol-2-yl)-3-hydroxypent-2-enenitrile
Also Known As: BAS 01816565, IDI1_009629, (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile, AB00099504-01, F0797-0037
| Molecular Formula | C12H11N3O |
|---|---|
| Molecular Weight | 213.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.09021 |
| Heavy Atoms | 16 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 301344-10-5 |
|---|---|
| SMILES | CC/C(=C(\C#N)/C1=NC2=CC=CC=C2N1)/O |
| InChIKey | BSQHESYAAZYILW-FLIBITNWSA-N |
Product Overview
(Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile (CAS 301344-10-5), with molecular formula C12H11N3O and molecular weight 213.09 g/mol. IUPAC: (Z)-2-(1H-benzimidazol-2-yl)-3-hydroxypent-2-enenitrile.
Chemical Property Profile of (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile
Property Insights of (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile. Following Lipinski's Rule of Five, (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile?
The CAS number of (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile is 301344-10-5.
What is the molecular formula of (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile?
The molecular formula of (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile is C12H11N3O.
What is the molecular weight of (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile?
The molecular weight of (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile is 213.09 g/mol.
Where can I buy (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile?
You can request a quote for (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(1H-benzo[d]imidazol-2-yl)-3-hydroxypent-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.