CS-1001864
2-[7-Fluoro-3,4-dihydro-3-oxo-4-(2-propyn-1-yl)-2H-1,4-benzoxazin-6-yl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Manufacturer: ChemScene
CAS Number: 1639205-98-3
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₉H₁₅FN₂O₄
Molecular Weight
354.33
Synonyms
None
SMILES
O=C1N(C2=CC(=C(F)C=C2OC1)N3C(=O)C4CC=CCC4C3=O)CC#C
Tpsa
66.92
Logp
1.6399
H Acceptors
4
H Donors
0
Rotatable Bonds
2
Related Products
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₁₅FN₂O₄
Molecular Weight: 354.33
Synonyms: None
SMILES: O=C1N(C2=CC(=C(F)C=C2OC1)N3C(=O)C4CC=CCC4C3=O)CC#C
Tpsa: 66.92
Logp: 1.6399
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₁₅FN₂O₄
Molecular Weight:
354.33
Synonyms:
None
SMILES:
O=C1N(C2=CC(=C(F)C=C2OC1)N3C(=O)C4CC=CCC4C3=O)CC#C
Tpsa:
66.92
Logp:
1.6399
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₃N₃O₂
Molecular Weight: 361.44
Synonyms: None
SMILES: C(CCOC(=O)C1=CC=CC=C1)N2C=3C(=CC(C[C@@H](C)N)=CC3C#N)C=C2
Tpsa: 81.04
Logp: 3.64978
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₃N₃O₂
Molecular Weight:
361.44
Synonyms:
None
SMILES:
C(CCOC(=O)C1=CC=CC=C1)N2C=3C(=CC(C[C@@H](C)N)=CC3C#N)C=C2
Tpsa:
81.04
Logp:
3.64978
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
7
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₈N₂O
Molecular Weight: 302.37
Synonyms: None
SMILES: N=1C(=NC(=CC1C)C)OC=C(C=2C=CC=CC2)C=3C=CC=CC3
Tpsa: 35.01
Logp: 4.56164
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 4
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₈N₂O
Molecular Weight:
302.37
Synonyms:
None
SMILES:
N=1C(=NC(=CC1C)C)OC=C(C=2C=CC=CC2)C=3C=CC=CC3
Tpsa:
35.01
Logp:
4.56164
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₈F₂O₃
Molecular Weight: 250.20
Synonyms: None
SMILES: O=C(O)C=1C=C(C=CC1O)C=2C(F)=CC=CC2F
Tpsa: 57.53
Logp: 3.0356
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₈F₂O₃
Molecular Weight:
250.20
Synonyms:
None
SMILES:
O=C(O)C=1C=C(C=CC1O)C=2C(F)=CC=CC2F
Tpsa:
57.53
Logp:
3.0356
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2