N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine

C306H228N18O6 — CID 58050786

IUPACN-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine
SMILESCCN1c2ccccc2Oc2cc(N(c3ccc4c(c3)C(C)(C)c3cc(-c5cc(-c6cc(-c7cc(-c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccc%11c(c%10)Oc%10ccccc%10N%11CC)c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10)ccc8-9)cc(-c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccc%11c(c%10)Oc%10ccccc%10N%11CC)c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10)ccc8-9)c7)cc(-c7cc(-c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccc%11c(c%10)Oc%10ccccc%10N%11CC)c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10)ccc8-9)cc(-c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccc%11c(c%10)Oc%10ccccc%10N%11CC)c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10)ccc8-9)c7)c6)cc(-c6ccc7c(c6)C(C)(C)c6cc(N(c8ccc9c(c8)Oc8ccccc8N9CC)c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc6-7)c5)ccc3-4)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc21
InChIInChI=1S/C306H228N18O6/c1-19-307-277-91-55-61-97-289(277)325-295-181-223(121-145-283(295)307)313(211-115-139-271-247(169-211)241-79-43-49-85-265(241)319(271)205-67-31-25-32-68-205)217-109-133-235-229-127-103-187(163-253(229)301(7,8)259(235)175-217)193-151-194(188-104-128-230-236-134-110-218(176-260(236)302(9,10)254(230)164-188)314(224-122-146-284-296(182-224)326-290-98-62-56-92-278(290)308(284)20-2)212-116-140-272-248(170-212)242-80-44-50-86-266(242)320(272)206-69-33-26-34-70-206)155-199(154-193)202-160-203(200-156-195(189-105-129-231-237-135-111-219(177-261(237)303(11,12)255(231)165-189)315(225-123-147-285-297(183-225)327-291-99-63-57-93-279(291)309(285)21-3)213-117-141-273-249(171-213)243-81-45-51-87-267(243)321(273)207-71-35-27-36-72-207)152-196(157-200)190-106-130-232-238-136-112-220(178-262(238)304(13,14)256(232)166-190)316(226-124-148-286-298(184-226)328-292-100-64-58-94-280(292)310(286)22-4)214-118-142-274-250(172-214)244-82-46-52-88-268(244)322(274)208-73-37-28-38-74-208)162-204(161-202)201-158-197(191-107-131-233-239-137-113-221(179-263(239)305(15,16)257(233)167-191)317(227-125-149-287-299(185-227)329-293-101-65-59-95-281(293)311(287)23-5)215-119-143-275-251(173-215)245-83-47-53-89-269(245)323(275)209-75-39-29-40-76-209)153-198(159-201)192-108-132-234-240-138-114-222(180-264(240)306(17,18)258(234)168-192)318(228-126-150-288-300(186-228)330-294-102-66-60-96-282(294)312(288)24-6)216-120-144-276-252(174-216)246-84-48-54-90-270(246)324(276)210-77-41-30-42-78-210/h25-186H,19-24H2,1-18H3
InChIKeyCELSXWPOYTVGDL-UHFFFAOYSA-N
MW4253.31 g/mol
LogP83.51
Rot. Bonds39

About N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine

N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine (PubChem CID 58050786) has the molecular formula C306H228N18O6 and a molecular weight of 4253.31 g/mol. Its IUPAC name is N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine.

Molecular Properties

Compound NameN-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine
PubChem CID58050786
Molecular FormulaC306H228N18O6
Molecular Weight4253.31 g/mol
Exact Mass4249.81
IUPAC NameN-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine
SMILESCCN1c2ccccc2Oc2cc(N(c3ccc4c(c3)C(C)(C)c3cc(-c5cc(-c6cc(-c7cc(-c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccc%11c(c%10)Oc%10ccccc%10N%11CC)c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10)ccc8-9)cc(-c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccc%11c(c%10)Oc%10ccccc%10N%11CC)c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10)ccc8-9)c7)cc(-c7cc(-c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccc%11c(c%10)Oc%10ccccc%10N%11CC)c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10)ccc8-9)cc(-c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccc%11c(c%10)Oc%10ccccc%10N%11CC)c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10)ccc8-9)c7)c6)cc(-c6ccc7c(c6)C(C)(C)c6cc(N(c8ccc9c(c8)Oc8ccccc8N9CC)c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc6-7)c5)ccc3-4)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc21
InChIInChI=1S/C306H228N18O6/c1-19-307-277-91-55-61-97-289(277)325-295-181-223(121-145-283(295)307)313(211-115-139-271-247(169-211)241-79-43-49-85-265(241)319(271)205-67-31-25-32-68-205)217-109-133-235-229-127-103-187(163-253(229)301(7,8)259(235)175-217)193-151-194(188-104-128-230-236-134-110-218(176-260(236)302(9,10)254(230)164-188)314(224-122-146-284-296(182-224)326-290-98-62-56-92-278(290)308(284)20-2)212-116-140-272-248(170-212)242-80-44-50-86-266(242)320(272)206-69-33-26-34-70-206)155-199(154-193)202-160-203(200-156-195(189-105-129-231-237-135-111-219(177-261(237)303(11,12)255(231)165-189)315(225-123-147-285-297(183-225)327-291-99-63-57-93-279(291)309(285)21-3)213-117-141-273-249(171-213)243-81-45-51-87-267(243)321(273)207-71-35-27-36-72-207)152-196(157-200)190-106-130-232-238-136-112-220(178-262(238)304(13,14)256(232)166-190)316(226-124-148-286-298(184-226)328-292-100-64-58-94-280(292)310(286)22-4)214-118-142-274-250(172-214)244-82-46-52-88-268(244)322(274)208-73-37-28-38-74-208)162-204(161-202)201-158-197(191-107-131-233-239-137-113-221(179-263(239)305(15,16)257(233)167-191)317(227-125-149-287-299(185-227)329-293-101-65-59-95-281(293)311(287)23-5)215-119-143-275-251(173-215)245-83-47-53-89-269(245)323(275)209-75-39-29-40-76-209)153-198(159-201)192-108-132-234-240-138-114-222(180-264(240)306(17,18)258(234)168-192)318(228-126-150-288-300(186-228)330-294-102-66-60-96-282(294)312(288)24-6)216-120-144-276-252(174-216)246-84-48-54-90-270(246)324(276)210-77-41-30-42-78-210/h25-186H,19-24H2,1-18H3
InChIKeyCELSXWPOYTVGDL-UHFFFAOYSA-N
XLogP83.51
TPSA123.84 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds39
Heavy Atoms330
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004253.31
LogP ≤ 583.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine?
The IUPAC name of N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine (CID 58050786) is N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine.
What is the SMILES notation for N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine?
The canonical SMILES for N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine is CCN1c2ccccc2Oc2cc(N(c3ccc4c(c3)C(C)(C)c3cc(-c5cc(-c6cc(-c7cc(-c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccc%11c(c%10)Oc%10ccccc%10N%11CC)c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10)ccc8-9)cc(-c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccc%11c(c%10)Oc%10ccccc%10N%11CC)c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10)ccc8-9)c7)cc(-c7cc(-c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccc%11c(c%10)Oc%10ccccc%10N%11CC)c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10)ccc8-9)cc(-c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccc%11c(c%10)Oc%10ccccc%10N%11CC)c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10)ccc8-9)c7)c6)cc(-c6ccc7c(c6)C(C)(C)c6cc(N(c8ccc9c(c8)Oc8ccccc8N9CC)c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc6-7)c5)ccc3-4)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc21.
What is the InChIKey of N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine?
The InChIKey is CELSXWPOYTVGDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C306H228N18O6/c1-19-307-277-91-55-61-97-289(277)325-295-181-223(121-145-283(295)307)313(211-115-139-271-247(169-211)241-79-43-49-85-265(241)319(271)205-67-31-25-32-68-205)217-109-133-235-229-127-103-187(163-253(229)301(7,8)259(235)175-217)193-151-194(188-104-128-230-236-134-110-218(176-260(236)302(9,10)254(230)164-188)314(224-122-146-284-296(182-224)326-290-98-62-56-92-278(290)308(284)20-2)212-116-140-272-248(170-212)242-80-44-50-86-266(242)320(272)206-69-33-26-34-70-206)155-199(154-193)202-160-203(200-156-195(189-105-129-231-237-135-111-219(177-261(237)303(11,12)255(231)165-189)315(225-123-147-285-297(183-225)327-291-99-63-57-93-279(291)309(285)21-3)213-117-141-273-249(171-213)243-81-45-51-87-267(243)321(273)207-71-35-27-36-72-207)152-196(157-200)190-106-130-232-238-136-112-220(178-262(238)304(13,14)256(232)166-190)316(226-124-148-286-298(184-226)328-292-100-64-58-94-280(292)310(286)22-4)214-118-142-274-250(172-214)244-82-46-52-88-268(244)322(274)208-73-37-28-38-74-208)162-204(161-202)201-158-197(191-107-131-233-239-137-113-221(179-263(239)305(15,16)257(233)167-191)317(227-125-149-287-299(185-227)329-293-101-65-59-95-281(293)311(287)23-5)215-119-143-275-251(173-215)245-83-47-53-89-269(245)323(275)209-75-39-29-40-76-209)153-198(159-201)192-108-132-234-240-138-114-222(180-264(240)306(17,18)258(234)168-192)318(228-126-150-288-300(186-228)330-294-102-66-60-96-282(294)312(288)24-6)216-120-144-276-252(174-216)246-84-48-54-90-270(246)324(276)210-77-41-30-42-78-210/h25-186H,19-24H2,1-18H3.
What are the key properties of N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine?
N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine has a molecular weight of 4253.31 g/mol, XLogP of 83.51, 39 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-[3-[3,5-bis[3,5-bis[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]phenyl]-5-[7-[(10-ethylphenoxazin-3-yl)-(9-phenylcarbazol-3-yl)amino]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-10-ethyl-N-(9-phenylcarbazol-3-yl)phenoxazin-3-amine is sourced from PubChem (CID 58050786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).