CAS RN: 1234365-97-9
Tenapanor HCl
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250103 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260304 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20260306 | 10mg / 25mg | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20251216 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20251007 | 50mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1234365-97-9
- Purity/Analytical Methods: >99.0%
1234365-97-9 / 1-[2-[2-[2-[[3-[(4S)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]sulfonylamino]ethoxy]ethoxy]ethyl]-3-[4-[2-[2-[2-[[3-[(4S)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]sulfonylamino]ethoxy]ethoxy]ethylcarbamoylamino]butyl]urea;dihydrochloride
Basic Information
CAS
1234365-97-9
Multi CAS
No
Molecular Formula
C50H68Cl6N8O10S2
Molecular Weight
1218.000000
Exact Mass
1216.260149
SMILES
CN1C[C@H](C2=C(C1)C(=CC(=C2)Cl)Cl)C3=CC(=CC=C3)S(=O)(=O)NCCOCCOCCNC(=O)NCCCCNC(=O)NCCOCCOCCNS(=O)(=O)C4=CC=CC(=C4)[C@@H]5CN(CC6=C5C=C(C=C6Cl)Cl)C.Cl.Cl
InChI
InChI=1S/C50H66Cl4N8O10S2.2ClH/c1-61-31-43(41-27-37(51)29-47(53)45(41)33-61)35-7-5-9-39(25-35)73(65,66)59-15-19-71-23-21-69-17-13-57-49(63)55-11-3-4-12-56-50(64)58-14-18-70-22-24-72-20-16-60-74(67,68)40-10-6-8-36(26-40)44-32-62(2)34-46-42(44)28-38(52)30-48(46)54;;/h5-10,25-30,43-44,59-60H,3-4,11-24,31-34H2,1-2H3,(H2,55,57,63)(H2,56,58,64);2*1H/t43-,44-;;/m0../s1
InChIKey
VFRAXTZDILCRKY-OWRGXFNZSA-N
Computed Properties
Structural Parameters
Heavy atom count
76
Aromatic heavy atom count
24
Fraction Csp3
0.48
Rotatable bonds
29
H-bond acceptors
12
H-bond donors
6
Molar refractivity
302.35
TPSA
218
LogP / Solubility
WLOGP
7
MLOGP
6.28
XLogP3
7
Consensus LogP
6.76
Log S (ESOL)
-10.12
Class (ESOL)
Insoluble
Log S (Ali)
-14.6
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-16.87
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-5.18
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
6.5
Safety & Transport
Pictogram(s)
Health Hazard
Signal
Warning
GHS Hazard Statements
H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]
Precautionary Statement Codes
P260, P319, and P501
Customers Also Viewed
-
(1S)-2-bromo-1-(4-fluorophenyl)ethanol
- CAS RN: 1234372-12-3
- Product Code: starshine_CAS1234372-12-3
- Purity/Analytical method: >99.0%
-
![CAS 1234387-33-7 3-[2-(2-Iodoethoxy)-ethoxy]-propyne molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1234387-33-7.gif)
-
-
![CAS 1234474-57-7 3-Benzofuranacetic acid, 6-[[2′,6′-dimethyl-4′-[3-(methylsulfonyl)propoxy][1,1′-biphenyl]-3-yl]methoxy]-2,3-dihydro-, (3R)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1234474-57-7.gif)
3-Benzofuranacetic acid, 6-[[2′,6′-dimethyl-4′-[3-(methylsulfonyl)propoxy][1,1′-biphenyl]-3-yl]methoxy]-2,3-dihydro-, (3R)-
- CAS RN: 1234474-57-7
- Product Code: starshine_CAS1234474-57-7
- Purity/Analytical method: >99.0%
-
(R)-Methyl 2-(6-hydroxy-2,3-dihydrobenzofuran-3-yl)acetate
- CAS RN: 1234474-58-8
- Product Code: starshine_CAS1234474-58-8
- Purity/Analytical method: >99.0%
-
![CAS 1234479-75-4 2-chloro-5,11-diMethyl-5H-benzo[e]pyriMido[5,4-b][1,4]diazepin-6(11H)-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1234479-75-4.gif)
2-chloro-5,11-diMethyl-5H-benzo[e]pyriMido[5,4-b][1,4]diazepin-6(11H)-one
- CAS RN: 1234479-75-4
- Product Code: SSC-027128