CAS RN: 620-91-7
DTPD OEKANAL (N N’-DITOLYLPARAPHENYLENE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250208 | 50mg / 100mg / 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS620-91-7
- Purity/Analytical Methods: >99.0%
620-91-7 / 1-N,4-N-bis(4-methylphenyl)benzene-1,4-diamine
Basic Information
CAS
620-91-7
Multi CAS
Yes
Molecular Formula
C20H20N2
Molecular Weight
288.400000
Exact Mass
288.162649
InChI
InChI=1S/C20H20N2/c1-15-3-7-17(8-4-15)21-19-11-13-20(14-12-19)22-18-9-5-16(2)6-10-18/h3-14,21-22H,1-2H3
InChIKey
JBMMSVXRQPXCGP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
18
Fraction Csp3
0.1
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
2
Molar refractivity
95.37
TPSA
24.06
LogP / Solubility
WLOGP
5.79
MLOGP
5.11
XLogP3
5.7
Consensus LogP
5.53
Log S (ESOL)
-5.62
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.11
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.82
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.37
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
1,3-di-p-tolylurea
- CAS RN: 621-00-1
- Product Code: starshine_CAS621-00-1
- Purity/Analytical method: >99.0%
-
-
MALONANILIDE
- CAS RN: 621-10-3
- Product Code: starshine_CAS621-10-3
- Purity/Analytical method: >99.0%
-
-
3-ETHYLAMINOPHENOL
- CAS RN: 621-31-8
- Product Code: starshine_CAS621-31-8
- Purity/Analytical method: >99.0%
-
m-methylphenetole
- CAS RN: 621-32-9
- Product Code: starshine_CAS621-32-9
- Purity/Analytical method: >99.0%
