CAS RN: 886999-35-5
N-Triphenylmethyl Irbesartan
Product Availability
Choose a grade to view its available package options.
6 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251015 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260303 | 1g | In stock | Shanghai, Tianjin, Chengdu | Inquiry |
| Batchno.20250811 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20251123 | 250mg | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20251110 | 25g | In stock | Shanghai | Inquiry |
| Batchno.20251130 | 5g | In stock | Shanghai, Shenzhen, Tianjin, Chengdu | Inquiry |
- Product code: starshine_CAS886999-35-5
- Purity/Analytical Methods: >99.0%
886999-35-5 / 2-butyl-3-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]-1,3-diazaspiro[4.4]non-1-en-4-one
Basic Information
CAS
886999-35-5
Multi CAS
Yes
Molecular Formula
C44H42N6O
Molecular Weight
670.800000
Exact Mass
670.342010
InChI
InChI=1S/C44H42N6O/c1-2-3-25-40-45-43(30-15-16-31-43)42(51)49(40)32-33-26-28-34(29-27-33)38-23-13-14-24-39(38)41-46-47-48-50(41)44(35-17-7-4-8-18-35,36-19-9-5-10-20-36)37-21-11-6-12-22-37/h4-14,17-24,26-29H,2-3,15-16,25,30-32H2,1H3
InChIKey
IPEZQBALWLNRGH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
51
Aromatic heavy atom count
35
Fraction Csp3
0.25
Rotatable bonds
11
H-bond acceptors
6
Molar refractivity
202
TPSA
76.27
LogP / Solubility
WLOGP
9.09
MLOGP
8.06
XLogP3
9
Consensus LogP
8.72
Log S (ESOL)
-9.51
Class (ESOL)
Insoluble
Log S (Ali)
-11.62
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.89
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.36
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
7.5
Customers Also Viewed
-
1-(4-Fluorophenyl)-5-methyl-1,2,3-triazole-4-carboxylic Acid
- CAS RN: 887035-89-4
- Product Code: SSC-200190
-
-
Thioacetic acid S-(2-cyano-benzyl) ester
- CAS RN: 887092-54-8
- Product Code: starshine_CAS887092-54-8
- Purity/Analytical method: >99.0%
-
1-BENZENESULFONYL-3-IODO-1H-PYRROLO[2,3-B]PYRIDINE
- CAS RN: 887115-53-9
- Product Code: starshine_CAS887115-53-9
- Purity/Analytical method: >99.0%
-
-
tert-butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate
- CAS RN: 887120-96-9
- Product Code: SSC-200195
![CAS 887090-42-8 [(PYRIDIN-3-YLMETHYL)THIO]ACETIC ACID molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB3293663.gif)
![CAS 887115-53-9 1-BENZENESULFONYL-3-IODO-1H-PYRROLO[2,3-B]PYRIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/887115-53-9.gif)
![CAS 887115-56-2 5-Bromo-1-methyl-1H-pyrazolo[3,4-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/887115-56-2.gif)
![CAS 887120-96-9 tert-butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/887120-96-9.gif)